SCHEMBL7008869

SCHEMBL7008869

CC(=O)Nc1cccc(-c2ccc(C)c(CCl)c2C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.47
HSD17B10 Q99714 1/20 0.47
BRD4 O60885 1/20 0.46
NQO2 P16083 2/20 0.46
USP7 Q93009 1/20 0.45
PIK3C3 Q8NEB9 1/20 0.44
RAB9A P51151 4/20 0.43
POLB P06746 3/20 0.43
NR4A1 P22736 1/20 0.43
NPC1 O15118 3/20 0.43
RXFP1 Q9HBX9 1/20 0.43
CYP17A1 P05093 1/20 0.43
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
CNR1 P21554 1/20 0.43
ALDH1A1 P00352 3/20 0.43
CYP1A2 P05177 1/20 0.43
TSHR P16473 1/20 0.43
MAPT P10636 2/20 0.43
KDM4E B2RXH2 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
SCHEMBL7016946 0.88 HSD17B10 (0.48) SMN1; SMN2HSD17B10BRD4NQO2USP7
SCHEMBL7012168 0.76 NPC1 (0.47) SMN1; SMN2RAB9ANPC1ALDH1A1TSHR
SCHEMBL7012170 0.76 NPC1 (0.47) SMN1; SMN2RAB9ANPC1ALDH1A1TSHR
SCHEMBL14003396 0.75 HSD17B10 (0.63) SMN1; SMN2HSD17B10BRD4NQO2USP7
SCHEMBL7016917 0.74 BDKRB2 (0.49) ALDH1A1MAPTMEN1KMT2A
SCHEMBL10755148 0.72 PDCD1 (0.43) RAB9APOLBALDH1A1MAPTKDM4E
SCHEMBL11222535 0.72 PIK3C3 (0.55) SMN1; SMN2HSD17B10BRD4NQO2USP7
SCHEMBL28789074 0.72 NR1H4 (0.57) SMN1; SMN2HSD17B10BRD4NQO2PIK3C3
SCHEMBL17736353 0.71 NQO2 (0.57) SMN1; SMN2HSD17B10BRD4NQO2RAB9A
SCHEMBL2961823 0.70 HSD17B10 (0.59) SMN1; SMN2HSD17B10BRD4NQO2USP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0861243-B1 HETEROCYCLIC COMPOUNDS AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 2003-11-12 EP disclosed
US-6344462-B1 Heterocyclic compounds as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-02-05 US disclosed
US-6127389-A TREATMENT OF HYPERTENSION, RENAL DISEASES, HEART FAILURE, HYPERTENSION, MENIERE'S DISEASE, PERIPHERAL AND CEREBRAL CIRCULATORY DISORDERS, CLIMACTERIC DISTURBANCE, RETINOCHOROIDAL CIRCULATORY DISORDERS, MYOCARDIAL ISCHEMIA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-10-03 US disclosed
US-6100284-A ANTIALLERGENS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-08-08 US disclosed
US-6015818-A TREATING KIDNEY, BRAIN, AND CARDIOVASCULAR DISORDERS; HYPOTENSIVE AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-01-18 US disclosed
US-6008229-A TREATING ALLERGY, INFLAMMATION, AUTOIMMUNE DISEASE, SHOCK, PAIN FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-12-28 US disclosed
EP-0879233-A1 CHINOLINE AND BENZIMIDAZOLE DERIVATIVES AS BRADYKININ AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-11-25 EP disclosed
EP-0861243-A1 HETEROCYCLIC COMPOUNDS AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-09-02 EP disclosed
WO-1997028153-A1 CHINOLINE AND BENZIMIDAZOLE DERIVATIVES AS BRADYKININ AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-08-07 WO disclosed
WO-1997011069-A1 HETEROCYCLIC COMPOUNDS AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-03-27 WO disclosed