SCHEMBL855573

SCHEMBL855573

Nc1ccc(N(CCO)CCO)c(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CYP3A4 P08684 5/20 0.43
TSHR P16473 2/20 0.43
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
ALDH3A1 P30838 1/20 0.39
ALDH1A3 P47895 1/20 0.39
ALDH1A1 P00352 5/20 0.39
THRB P10828 2/20 0.39
ALOX15 P16050 2/20 0.39
HPGD P15428 1/20 0.39
CASP1 P29466 1/20 0.39
RECQL P46063 1/20 0.39
HSD17B10 Q99714 1/20 0.39
KMT2A Q03164 4/20 0.36
MAPT P10636 3/20 0.36
MEN1 O00255 3/20 0.36
CHRM2 P08172 1/20 0.36
CHRM3 P20309 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6816397 0.82 CYP3A4 (0.41) CA1CA2CYP3A4TSHRCYP2C9
Hydrochloric Acid SCHEMBL7472111 0.81 CYP3A4 (0.43) CA1CA2CYP3A4TSHRCYP2C9
SCHEMBL6816877 0.81 ALDH3A1 (0.58) CA1CA2CYP3A4TSHRCYP2C9
SCHEMBL8640578 0.81 CASP1 (0.35) TSHRALDH1A1THRBCASP1RECQL
SCHEMBL6574139 0.79 PLA2G7 (0.50) CYP3A4TSHRCYP2C9CYP2C19ALDH1A1
SCHEMBL20776804 0.79 NR1H2 (0.43) KMT2AMEN1
SCHEMBL10810768 0.79 ALDH3A1 (0.47) CA1CA2CYP3A4TSHRCYP2C9
SCHEMBL6571903 0.78 KMT2A (0.38) ALDH1A1HPGDHSD17B10KMT2AMAPT
SCHEMBL6739710 0.78 CYP3A4 (0.34) CA1CA2CYP3A4TSHRCYP2C9
SCHEMBL6573366 0.78 CYP3A4 (0.42) CYP3A4TSHRKMT2AKCNH2LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 227 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1473025-B1 Dyeing composition containing 2-chloro-6-methyl-3-aminophenol and an associative polymer OREAL (FR) 2012-03-28 EP claimed
US-7306630-B2 Composition comprising at least one coupler chosen from 2-chloro-6-methyl-3-aminophenol and addition salts thereof, at least one oxidation base, and at least one associative polymer comprising at least one C8-C30 fatty chain L'OREAL S.A. (FR) 2007-12-11 US claimed
WO-2007071686-A1 COMPOSITION FOR DYEING KERATIN FIBRES WITH A TETRAAZAPENTAMETHINE CATIONIC DIRECT DYE, AN OXIDATION BASE AND A PARTICULAR COUPLER L'ORÉAL (FR) 2007-06-28 WO claimed
US-7141078-B2 Oxidation dyeing composition for keratinous fiber and dyeing method using same L′Oreal (FR) 2006-11-28 US claimed
US-7141079-B2 Oxidation dyeing composition for keratinous fibers and dyeing method using same L′Oreal (FR) 2006-11-28 US claimed
EP-1274393-B1 OXIDATION DYEING COMPOSITION FOR KERATINOUS FIBRES AND METHOD USING SAME OREAL (FR) 2006-07-05 EP claimed
US-20050028302-A1 Dye composition comprising at least one oxidation base, 2-chloro-6-methyl-3-aminophenol and 3-methyl-1-phenyl-5-pyrazolone L'OREAL S.A. (FR) 2005-02-10 US claimed
US-20050000039-A1 Composition comprising at least one coupler chosen from 2-chloro-6-methyl-3-aminophenol and addition salts thereof, at least one oxidation base, and at least one associative polymer comprising at least one C8-C30 fatty chain L'OREAL S.A. (FR) 2005-01-06 US claimed
US-20040194232-A1 Oxidizing composition and uses for dyeing, for permanently reshaping or for bleaching keratin fibers L'OREAL S.A. 2004-10-07 US claimed
US-6783559-B2 AT LEAST ONE FIRST OXIDATION BASE, AT LEAST ONE SECOND OXIDATION BASE CHOSEN FROM PARA-AMINOPHENOLS, AT LEAST ONE META-AMINOPHENOL AS COUPLER AND AT LEAST ONE ENZYME OF 2-ELECTRON OXIDOREDUCTASE TYPE IN THE PRESENCE OF AT LEAST ONE L'OREAL S.A. (FR) 2004-08-31 US claimed
US-20010049850-A1 Mixture containing 2-amino-3-hydroxypyridine coupler and oxidoreductase enzyme L'OREAL S.A. (FR) 2001-12-13 US claimed
US-6312479-B1 OXIDATION BASE; COUPLER CHOSEN FROM 2-AMINO-3-HYDROXYPYRIDINES AND ACID-ADDITION SALTS THEREOF; A 2-ELECTRON OXIDOREDUCTASE; AND A DONOR FOR SAID ENZYME. L'OREAL S.A. (FR) 2001-11-06 US claimed
EP-0974336-B1 Composition for oxidative dying of keratinous fibres and dying process therewith OREAL (FR) 2001-09-12 EP claimed
US-6241784-B1 COSMETICS OR SKIN COMPOSITION FOR TREATING FIBERS L'OREAL S.A. (FR) 2001-06-05 US claimed
US-6228129-B1 OXIDATION BASE, CATIONIC DIRECT DYE AND AN ENZYME OF 2-ELECTRON OXIDOREDUCTASES IN THE PRESENCE OF A DONOR FOR THE ENZYME L'OREAL S.A. (FR) 2001-05-08 US claimed
EP-1077929-A1 2,3,5-SUBSTITUTED BIPHENYLS USEFUL IN THE TREATMENT OF INSULIN RESISTANCE AND HYPERGLYCEMIA AMERICAN HOME PRODUCTS CORPORATION (US) 2001-02-28 EP claimed
US-6152967-A COMPOSITION FOR HAIR DYEING COMPRISING AT LEAST ONE OXIDATION BASE AND BILIRUBIN OXIDASE L'OREAL (FR) 2000-11-28 US claimed
US-6099590-A READY-TO-USE COMPOSITION COMPRISING OXIDATION BASE(S), CHOLINE OXIDASE(S), AND DONOR(S) FOR THE CHOLINE OXIDASE; MULTICOMPARTMENT DYE KITS; PROCESS FOR DYEING; STRONGER COLORATIONS L'OREAL (FR) 2000-08-08 US claimed
US-6090159-A READY-TO-USE OXIDATION DYEING COMPOSITION COMPRISING AN OXIDATION BASE, SARCOSINE OXIDASE AS OXIDIZER, AND AT LEAST ONE DONOR FOR THE ENZYME; STRONGER COLORATION, NO BLEACHING L'OREAL (FR) 2000-07-18 US claimed
WO-1999061410-A1 2,3,5-SUBSTITUTED BIPHENYLS USEFUL IN THE TREATMENT OF INSULIN RESISTANCE AND HYPERGLYCEMIA AMERICAN HOME PRODUCTS CORPORATION (US) 1999-12-02 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010049850-A1 Mixture containing 2-amino-3-hydroxypyridine coupler and oxidoreductase enzyme POR, QDPR, DPYD CA1 1401/4885CA2 668/4885CYP3A4 339/4885
US-20050000039-A1 Composition comprising at least one coupler chosen from 2-chloro-6-methyl-3-aminophenol and addition salts thereof, at least one oxidation base, and at least one associative polymer comprising at least one C8-C30 fatty chain FABP4, KRT18, S100A10 CA1 1007/4885CA2 751/4885CYP3A4 1530/4885
US-20040194232-A1 Oxidizing composition and uses for dyeing, for permanently reshaping or for bleaching keratin fibers KRT18, ALDH1A2, PPOX CA1 1417/4885CA2 887/4885CYP3A4 998/4885
US-20050028302-A1 Dye composition comprising at least one oxidation base, 2-chloro-6-methyl-3-aminophenol and 3-methyl-1-phenyl-5-pyrazolone KRT18, COX5A, COX5B CA1 3648/4885CA2 2521/4885CYP3A4 462/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.