SCHEMBL2938201

SCHEMBL2938201

O=C(O)C1CCCN1c1cccc(O)c1CCO

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.43
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
KEAP1 Q14145 5/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C19 P33261 1/20 0.37
SERPINE1 P05121 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ACE P12821 1/20 0.35
OGFRL1 Q5TC84 1/20 0.35

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
SCHEMBL2942979 0.87 SMN1; SMN2 (0.43) SMN1; SMN2KMT2AMEN1KEAP1CHRM2
SCHEMBL3000639 0.81 HRH3 (0.34) KMT2AMEN1
SCHEMBL2942284 0.80 SMN1; SMN2 (0.45) SMN1; SMN2KMT2AMEN1KEAP1ALDH1A1
SCHEMBL2939478 0.80 SMN1; SMN2 (0.45) SMN1; SMN2KMT2AMEN1KEAP1CHRM2
SCHEMBL2934025 0.80 SMN1; SMN2 (0.45) SMN1; SMN2KMT2AMEN1KEAP1CHRM2
SCHEMBL2941782 0.80 NR1I2 (0.39) KMT2AMEN1CHRM2CHRM4CHRM1
SCHEMBL2938205 0.78 NR1I2 (0.38) KMT2AMEN1ALDH1A1MAPT
SCHEMBL2976489 0.77 MAPT (0.50) SMN1; SMN2KMT2AMEN1ALDH1A1MAPT
SCHEMBL2988327 0.77 CYP2C19 (0.47) SMN1; SMN2ALDH1A1CYP2C19
SCHEMBL2932827 0.76 KMT2A (0.48) SMN1; SMN2KMT2AMEN1KEAP1ALDH1A1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7491244-B2 Oxidizing hair coloring agents containing m-aminophenol derivatives THE PROCTER & GAMBLE COMPANY (US) 2009-02-17 US claimed
WO-2007020565-A1 OXIDIZING HAIR COLORING AGENTS CONTAINING M-AMINOPHENOL DERIVATIVES THE PROCTER & GAMBLE COMPANY (US) 2007-02-22 WO claimed
US-20070033745-A1 Developer substance-coupler substance of 3-(1-pyrrolidinyl)phenol and 1,4-diaminobenzene PROCTER & GAMBLE COMPANY, THE 2007-02-15 US claimed
EP-1752192-A1 Oxidizing hair coloring agents containing m-Aminophenol derivatives Wella Aktiengesellschaft (DE) 2007-02-14 EP claimed
EP-1752192-B1 Oxidizing hair coloring agents containing m-Aminophenol derivatives PROCTER & GAMBLE (US) 2010-02-03 EP disclosed
US-7491244-B2 Oxidizing hair coloring agents containing m-aminophenol derivatives THE PROCTER & GAMBLE COMPANY (US) 2009-02-17 US disclosed
WO-2007020565-A1 OXIDIZING HAIR COLORING AGENTS CONTAINING M-AMINOPHENOL DERIVATIVES THE PROCTER & GAMBLE COMPANY (US) 2007-02-22 WO disclosed
US-20070033745-A1 Developer substance-coupler substance of 3-(1-pyrrolidinyl)phenol and 1,4-diaminobenzene PROCTER & GAMBLE COMPANY, THE 2007-02-15 US disclosed
EP-1752192-A1 Oxidizing hair coloring agents containing m-Aminophenol derivatives Wella Aktiengesellschaft (DE) 2007-02-14 EP disclosed

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

For each of this compound's patents that has machine-readable text (1 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-20070033745-A1 Developer substance-coupler substance of 3-(1-pyrrolidinyl)phenol and 1,4-diaminobenzene TACR1, KRT18, AKR1C4 SMN1; SMN2 4604/4885KMT2A 2065/4885MEN1 3075/4885

“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.