SCHEMBL6301703

SCHEMBL6301703

CCCC([NH])c1ccc2ccccc2c1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
UGT2B7 P16662 1/20 0.48
PPARG P37231 2/20 0.44
PPARA Q07869 2/20 0.44
CYP2D6 P10635 5/20 0.42
CYP1A2 P05177 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
AOC3 Q16853 2/20 0.42
TSHR P16473 1/20 0.42
HIF1A Q16665 1/20 0.42
CYP2A6 P11509 1/20 0.42
ATM Q13315 1/20 0.42
SLC6A2 P23975 6/20 0.41
SLC6A4 P31645 6/20 0.41
SLC6A3 Q01959 6/20 0.41
KCNH2 Q12809 5/20 0.41
CYP3A4 P08684 4/20 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
SCHEMBL6307993 0.89 UGT2B7 (0.46) UGT2B7PPARGPPARACYP2D6CYP1A2
SCHEMBL6008487 0.85 UGT2B7 (0.52) UGT2B7CYP2D6CYP1A2MEN1KMT2A
SCHEMBL11125206 0.81 UGT2B7 (0.52) UGT2B7PPARGPPARACYP2D6CYP1A2
SCHEMBL11051116 0.79 UGT2B7 (0.55) UGT2B7PPARGPPARACYP2D6CYP1A2
SCHEMBL7499011 0.78 UGT2B7 (0.48) UGT2B7PPARGPPARACYP2D6CYP1A2
SCHEMBL11624148 0.78 UGT2B7 (0.48) UGT2B7PPARGPPARACYP2D6CYP1A2
SCHEMBL6055328 0.78 MEN1 (0.58) UGT2B7PPARGPPARACYP2D6CYP1A2
SCHEMBL6303989 0.78 UGT2B7 (0.48) UGT2B7PPARGPPARACYP2D6CYP1A2
SCHEMBL28118626 0.78 UGT2B7 (0.48) UGT2B7PPARGPPARACYP2D6CYP1A2
SCHEMBL3248164 0.76 AOC3 (0.46) AOC3

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-6869950-B1 Benzimidazole derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-03-22 US disclosed
EP-1142880-A1 BENZIMIDAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-10-10 EP disclosed