SCHEMBL295953

SCHEMBL295953

O=S(=O)(Cl)c1ccc(-n2cccn2)cc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.61
ALDH1A1 P00352 2/20 0.56
KDM4E B2RXH2 1/20 0.56
MAPK1 P28482 1/20 0.56
KMT2A Q03164 4/20 0.56
MEN1 O00255 3/20 0.56
MAPT P10636 5/20 0.55
POLB P06746 1/20 0.52
TP53 P04637 2/20 0.51
PKM P14618 1/20 0.49
CHRM1 P11229 1/20 0.47
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL7657790 0.91 NOTUM (0.51) NOTUMALDH1A1KDM4EMAPK1KMT2A
SCHEMBL4881585 0.84 CA12 (0.57) NOTUMALDH1A1KDM4EMAPK1KMT2A
SCHEMBL3112806 0.84 MAPT (0.57) NOTUMALDH1A1KDM4EMAPK1KMT2A
SCHEMBL13836239 0.84 KMT2A (0.55) NOTUMALDH1A1KDM4EMAPK1KMT2A
SCHEMBL1950149 0.83 NOTUM (0.58) NOTUMALDH1A1KDM4EMAPK1KMT2A
SCHEMBL478964 0.83 KAT6A (0.51) NOTUMALDH1A1KDM4EMAPK1KMT2A
SCHEMBL4341894 0.82 NOTUM (0.78) NOTUMALDH1A1KDM4EMAPK1KMT2A
SCHEMBL1661109 0.80 MAPT (0.50) NOTUMALDH1A1KDM4EMAPK1KMT2A
SCHEMBL13485837 0.80 MAPT (0.60) NOTUMALDH1A1KDM4EMAPK1KMT2A
SCHEMBL8203335 0.80 MAPT (0.54) NOTUMALDH1A1KDM4EMAPK1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100227412-A1 Simultaneous Detection of Estrogen and Non Estrogen Steroids PERKINELMER HEALTH SCIENCES, INC. (US) 2010-09-09 US claimed
WO-2010091264-A2 SIMULTANEOUS DETECTION OF ESTROGEN AND NON ESTROGEN STEROIDS PERKINELMER HEALTH SCIENCES, INC. (US) 2010-08-12 WO claimed
EP-2188272-B1 PHENYL- AND BENZYLTHIAZOLYLPIPERAZINE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES REMYND NV (BE) 2016-02-24 EP disclosed
EP-2456435-B1 HETEROARYL BENZAMIDES, COMPOSITIONS AND METHODS OF USE UNIV LELAND STANFORD JUNIOR (US) 2015-06-24 EP disclosed
EP-2507210-B1 CYCLOHEXANE DERIVATIVES AS INHIBITORS OF ACETYL-COA CARBOXYLASE (ACC) NOVARTIS AG (CH) 2015-04-08 EP disclosed
EP-2516445-B1 TRICYCLIC DERIVATIVES AND THEIR PHARMACEUTICAL USE AND COMPOSITIONS CEPHALON INC (US) 2015-03-11 EP disclosed
US-8969401-B2 Sulfonylpyrroles 4SC AG (DE) 2015-03-03 US disclosed
US-8722681-B2 N-sulfonyl thiazolylpiperazine derivatives and related N-sulfonyl heterocyclic derivatives for the treatment of neuro degenerative diseases NV REMYND (BE) 2014-05-13 US disclosed
US-8642808-B2 Bis-aryl sulfonamides CHEMOCENTRYX, INC. (US) 2014-02-04 US disclosed
US-8541406-B2 Thiadiazole derivatives for the treatment of neurodegenerative diseases NV REMYND (BE) 2013-09-24 US disclosed
EP-1725528-B1 SULPHONYLPYRROLES AS HDAC INHIBITORS 4SC AG (DE) 2013-05-29 EP disclosed
US-20050137179-A1 Bis-aryl sulfonamides CHEMOCENTRYX, INC. 2005-06-23 US disclosed
CN-1585775-A 6-O-acyl ketolide derivatives of erythromycine useful as antibacterials ORTHO MCNEIL PHARM INC (US) 2005-02-23 CN disclosed
US-6825170-B2 ERYTHROMYCIN TYPE MACROLIDE WITH A FUSED OXAZOLONE RING ORTHO-MCNEIL PHARMACEUTICAL, INC. 2004-11-30 US disclosed
WO-2004085384-A2 BIS-ARYL SULFONAMIDES CHEMOCENTRYX (US) 2004-10-07 WO disclosed
EP-1453847-A1 6-O-ACYL KETOLIDE DERIVATIVES OF ERYTHROMYCINE USEFUL AS ANTIBACTERIALS Ortho-Mcneil Pharmaceutical, Inc. (US) 2004-09-08 EP disclosed
WO-2004073606-A2 SULFONAMIDE DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2004-09-02 WO disclosed
US-20040167113-A1 Bis-aryl sulfonamides CHEMOCENTRYX, INC. 2004-08-26 US disclosed
US-20030220272-A1 6-O-acyl ketolide antibacterials ORTHO-MCNEIL PHARMACEUTICAL, INC. 2003-11-27 US disclosed
WO-2003050132-A1 6-O-ACYL KETOLIDE DERIVATIVES OF ERYTHROMYCINE USEFUL AS ANTIBACTERIALS ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2003-06-19 WO 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 (3 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-20030220272-A1 6-O-acyl ketolide antibacterials Q6ZSR9, ACSL6, RPS4Y1 NOTUM 2862/4885ALDH1A1 2109/4885KDM4E 18/4885
US-20050137179-A1 Bis-aryl sulfonamides CCR2, CXCR2, CCL2 NOTUM 3341/4885ALDH1A1 2054/4885KDM4E 4803/4885
US-20040167113-A1 Bis-aryl sulfonamides CCR2, CXCR2, CCL2 NOTUM 3341/4885ALDH1A1 2054/4885KDM4E 4803/4885

“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.