SCHEMBL8446102

SCHEMBL8446102

CC(C)(CNCc1ccc(Cl)cc1)Cn1ccnc1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.54
CYP11B1 P15538 2/20 0.54
CYP11B2 P19099 2/20 0.54
CYP2A6 P11509 1/20 0.54
CYP2B6 P20813 1/20 0.54
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
KDM4E B2RXH2 1/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
LMNA P02545 1/20 0.40

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
SCHEMBL8444566 0.77 CYP19A1 (0.44) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6
SCHEMBL8447183 0.77 CYP2A6 (0.51) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6
SCHEMBL10955545 0.77 OGG1 (0.53) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6
SCHEMBL11286288 0.76 CYP11B1 (0.61) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6
SCHEMBL6571544 0.74 CYP1A2 (0.61) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6
SCHEMBL8447144 0.73 CYP2A6 (0.56) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6
Hydrochloric Acid SCHEMBL8446022 0.72 CYP1A2 (0.55) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6
SCHEMBL11639842 0.72 CYP19A1 (0.55) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6
SCHEMBL11274893 0.72 CYP2A6 (0.55) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6
SCHEMBL570342 0.71 CYP11B1 (1.00) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0618907-B1 1-(ARYLALKYL-AMINOALKYL)IMIDAZOLE DERIVATIVES, PROCESSES OF PREPARATION AND USE AS THERAPEUTICAL AGENTS BRITISH TECH GROUP INT (GB) 1999-04-28 EP disclosed
US-5547972-A 1-(ARLALKYLAMINOALKYL) IMIDAZOLE DERIVATIVES THE BOOTS COMPANY PLC (GB) 1996-08-20 US disclosed
EP-0618907-A1 1-(ARYLALKYL-AMINOALKYL)IMIDAZOLE DERIVATIVES, PROCESSES OF PREPARATION AND USE AS THERAPEUTICAL AGENTS Knoll AG (DE) 1994-10-12 EP disclosed
WO-1993013075-A1 1-(ARYLALKYL-AMINOALKYL)IMIDAZOLE DERIVATIVES, PROCESSES OF PREPARATION AND USE AS THERAPEUTICAL AGENTS THE BOOTS COMPANY PLC (GB) 1993-07-08 WO disclosed