SCHEMBL7016624

SCHEMBL7016624

CNC(=O)c1ccc(C=CC(=O)Nc2cccc(-c3ccc(C)c(CO[Si](c4ccccc4)(c4ccccc4)C(C)(C)C)c3C)c2)cc1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 8/20 0.45
LTB4R Q15722 1/20 0.41
KDM4E B2RXH2 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
MMP1 P03956 4/20 0.39
MMP2 P08253 4/20 0.39
MMP9 P14780 4/20 0.39
TRPV1 Q8NER1 2/20 0.39
EGFR P00533 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
SENP1 Q9P0U3 2/20 0.38
SENP2 Q9HC62 1/20 0.38

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
SCHEMBL7016627 1.00 BDKRB2 (0.45) BDKRB2LTB4RKDM4ENPC1RAB9A
SCHEMBL7014316 0.82 NPC1 (0.48) BDKRB2LTB4RKDM4ENPC1RAB9A
SCHEMBL7014321 0.82 NPC1 (0.48) BDKRB2LTB4RKDM4ENPC1RAB9A
SCHEMBL7012168 0.81 NPC1 (0.47) BDKRB2LTB4RKDM4ENPC1RAB9A
SCHEMBL7012170 0.81 NPC1 (0.47) BDKRB2LTB4RKDM4ENPC1RAB9A
SCHEMBL7006790 0.81 NQO2 (0.43) NPC1RAB9AALDH1A1
SCHEMBL7012869 0.79 BDKRB2 (0.64) BDKRB2
SCHEMBL7012866 0.79 BDKRB2 (0.64) BDKRB2
SCHEMBL7011358 0.78 BDKRB2 (0.70) BDKRB2
SCHEMBL7011353 0.78 BDKRB2 (0.70) BDKRB2

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 8 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
WO-1997028153-A1 CHINOLINE AND BENZIMIDAZOLE DERIVATIVES AS BRADYKININ AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-08-07 WO disclosed