SCHEMBL7016635

SCHEMBL7016635

CNC(=O)c1ccc(C=CC(=O)Nc2cccc(-c3c(CO[SiH](c4ccccc4)c4ccccc4)cc(C)c(C(C)(C)C)c3C)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 3/20 0.42
LTB4R Q15722 1/20 0.41
MMP1 P03956 5/20 0.39
MMP2 P08253 5/20 0.39
MMP9 P14780 5/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
KDM4E B2RXH2 2/20 0.39
EGFR P00533 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
ALDH1A1 P00352 3/20 0.39
HPGD P15428 1/20 0.39
LMNA P02545 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 2/20 0.38
MAPK1 P28482 2/20 0.38
KMT2A Q03164 2/20 0.38
SENP1 Q9P0U3 4/20 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
SCHEMBL7006796 0.83 NQO2 (0.43) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL7008888 0.72 ALDH1A1 (0.34) MAOAALDH1A1SMN1; SMN2
SCHEMBL7012873 0.71 BDKRB2 (0.48) TRPV1MMP1MMP2MMP9ALDH1A1
SCHEMBL7016627 0.70 BDKRB2 (0.45) TRPV1LTB4RMMP1MMP2MMP9
SCHEMBL7016624 0.70 BDKRB2 (0.45) TRPV1LTB4RMMP1MMP2MMP9
SCHEMBL7014316 0.69 NPC1 (0.48) TRPV1LTB4RMMP1MMP2MMP9
SCHEMBL7014321 0.69 NPC1 (0.48) TRPV1LTB4RMMP1MMP2MMP9
SCHEMBL7012170 0.68 NPC1 (0.47) TRPV1LTB4RMMP1MMP2MMP9
SCHEMBL7012168 0.68 NPC1 (0.47) TRPV1LTB4RMMP1MMP2MMP9
SCHEMBL7008381 0.67 BDKRB2 (0.39) 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 6 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