SCHEMBL5327982

SCHEMBL5327982

N#Cc1ccc(-c2[c]cccc2)cc1F

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 18/20 0.50
CYP11B1 P15538 17/20 0.50
TRPV4 Q9HBA0 1/20 0.43
EGLN2 Q96KS0 1/20 0.41

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
SCHEMBL5330919 0.87 CNR2 (0.44) CYP11B2CYP11B1
SCHEMBL5326419 0.81 CYP11B2 (0.44) CYP11B2CYP11B1TRPV4EGLN2
SCHEMBL1134830 0.79 MAOB (0.38) CYP11B2CYP11B1
SCHEMBL5326735 0.77 ALDH1A1 (0.47)
SCHEMBL18297999 0.76 CYP11B2 (0.67) CYP11B2CYP11B1TRPV4
SCHEMBL1514257 0.75 CYP11B1 (0.78) CYP11B2CYP11B1TRPV4
SCHEMBL30132416 0.75 CYP11B1 (0.78) CYP11B2CYP11B1TRPV4
SCHEMBL5326217 0.75 ACHE (0.39)
SCHEMBL9612021 0.74 CYP11B2 (0.68) CYP11B2CYP11B1TRPV4
SCHEMBL5327983 0.74 CYP11B2 (0.58) CYP11B2CYP11B1TRPV4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007135527-A2 BENZIMIDAZOLYL COMPOUNDS PFIZER PRODUCTS INC. (US) 2007-11-29 WO claimed
WO-2007135527-A2 BENZIMIDAZOLYL COMPOUNDS PFIZER PRODUCTS INC. (US) 2007-11-29 WO disclosed
WO-2007135529-A2 AZABENZIMIDAZOLYL COMPOUNDS AS MGLUR2 POTENTIATORS PFIZER PRODUCTS INC. (US) 2007-11-29 WO disclosed