SCHEMBL6170445

SCHEMBL6170445

CCCc1nc2ccc(NC(C)=O)cc2n1Cc1ccccc1Cl

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGES O14684 4/20 0.65
MAPT P10636 3/20 0.58
ALDH1A1 P00352 2/20 0.58
HPGD P15428 1/20 0.58
TNF P01375 2/20 0.56
NPC1 O15118 1/20 0.56
GAA P10253 1/20 0.56
RAB9A P51151 1/20 0.56
TDP1 Q9NUW8 1/20 0.50
PPARG P37231 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ACSS2 Q9NR19 1/20 0.49
KDM4E B2RXH2 1/20 0.49
NOD2 Q9HC29 1/20 0.49
NOD1 Q9Y239 1/20 0.49
TP53 P04637 1/20 0.48

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
SCHEMBL6171147 0.91 PTGES (0.61) PTGESMAPTALDH1A1HPGDTNF
SCHEMBL6169794 0.87 PTGES (0.57) PTGESMAPTALDH1A1HPGDTNF
SCHEMBL6170381 0.84 PTGES (0.53) PTGESMAPTALDH1A1HPGDTNF
SCHEMBL6170472 0.83 PTGES (0.62) PTGESMAPTALDH1A1HPGDTNF
SCHEMBL7671121 0.82 AGTR1 (0.54) PTGESMAPTALDH1A1HPGDTNF
SCHEMBL6170375 0.82 AGTR1 (0.62) PTGESTDP1PPARGTP53
SCHEMBL7673926 0.82 TDP1 (0.62) PTGESMAPTALDH1A1HPGDTDP1
SCHEMBL7675982 0.82 TDP1 (0.57) PTGESMAPTALDH1A1HPGDTNF
SCHEMBL6170532 0.81 AGTR1 (0.55) PTGESMAPTALDH1A1HPGDTNF
SCHEMBL6170831 0.79 SMN1; SMN2 (0.54) PTGESMAPTALDH1A1HPGDTNF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882718-B1 BENZIMIDAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2005-08-31 EP disclosed
US-6369092-B1 Method for treating neoplasia by exposure to substituted benzimidazole derivatives CELL PATHWAYS, INC. 2002-04-09 US disclosed
US-6352985-B1 CARDIOVASCULAR DISORDERS OR GASTROINTESTINAL DISORDERS, DIABETES (TYPE II DIABETES), DIABETIC COMPLICATIONS METHOD FOR LOWERING THE BLOOD SUGAR LEVEL OF A PATIENT, FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-03-05 US disclosed
US-6166219-A Benzimidazole derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-12-26 US disclosed
EP-0882718-A1 BENZIMIDAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-12-09 EP disclosed