SCHEMBL7370892

SCHEMBL7370892

Cc1ccccc1-c1nc(C)c(-c2cccnc2)[nH]1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 6/20 0.57
CYP11B1 P15538 1/20 0.55
CYP11B2 P19099 1/20 0.55
NPC1 O15118 4/20 0.50
HPGD P15428 4/20 0.50
RAB9A P51151 4/20 0.50
KDM4E B2RXH2 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
TSHR P16473 1/20 0.50
AHR P35869 1/20 0.50
KIT P10721 1/20 0.48
ALDH1A1 P00352 3/20 0.48
HTT P42858 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48
LDHA P00338 1/20 0.46
EPHX2 P34913 1/20 0.46
MAPT P10636 2/20 0.43
STAT1 P42224 1/20 0.43
CYP2A6 P11509 3/20 0.43
TEK Q02763 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
SCHEMBL7369697 0.86 NPY5R (0.54) NPY5RCYP11B1CYP11B2NPC1HPGD
SCHEMBL7369715 0.86 CYP11B1 (0.52) NPY5RCYP11B1CYP11B2NPC1HPGD
SCHEMBL7376655 0.86 MGAM (0.52) NPY5RCYP11B1CYP11B2NPC1HPGD
SCHEMBL7370832 0.86 CYP11B1 (0.52) NPY5RCYP11B1CYP11B2NPC1HPGD
SCHEMBL7372656 0.84 ALOX5 (0.50) NPY5RCYP11B1CYP11B2NPC1HPGD
SCHEMBL27692933 0.84 CYP11B1 (0.50) NPY5RCYP11B1CYP11B2NPC1HPGD
Hydrochloric Acid SCHEMBL7369410 0.83 PDE5A (0.58) NPY5RCYP11B1CYP11B2SMN1; SMN2ALDH1A1
SCHEMBL7372422 0.83 NPY5R (0.57) NPY5RCYP11B1CYP11B2NPC1HPGD
SCHEMBL7374881 0.81 PRKCA (0.44) NPY5RCYP11B1CYP11B2NPC1HPGD
SCHEMBL7366257 0.81 PDE5A (0.56) NPY5RCYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4822805-A ANTIINFLAMMATORY AGENTS, CARDIOTONIC AGENTS, ANTIPLATELET AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-04-18 US disclosed
EP-0257897-A1 Imidazole compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-03-02 EP disclosed