SCHEMBL9032508

SCHEMBL9032508

N#Cc1ccc(-c2nc3cc(Cl)ccc3[nH]2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 2/20 0.72
DGAT1 O75907 1/20 0.53
SOAT1 P35610 1/20 0.53
KCNH2 Q12809 1/20 0.53
PKN1 Q16512 1/20 0.52
PKN2 Q16513 1/20 0.52
KDM4E B2RXH2 3/20 0.50
ALDH1A1 P00352 3/20 0.50
HPGD P15428 3/20 0.50
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
TP53 P04637 2/20 0.50
MAPT P10636 2/20 0.50
HSD17B10 Q99714 2/20 0.50
CYP3A4 P08684 1/20 0.50
MAPK1 P28482 1/20 0.50
FTO Q9C0B1 1/20 0.50
CHEK2 O96017 2/20 0.49
NPC1 O15118 3/20 0.48
RAB9A P51151 2/20 0.48

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
SCHEMBL15245075 0.99 RHEB (0.70) RHEBDGAT1SOAT1KCNH2PKN1
SCHEMBL3333407 0.91 RHEB (0.68) RHEBDGAT1SOAT1KCNH2PKN1
SCHEMBL20982583 0.88 RHEB (0.70) RHEBDGAT1SOAT1KCNH2PKN1
SCHEMBL9032997 0.87 ALDH1A1 (0.62) RHEBKDM4EALDH1A1HPGDKMT2A
SCHEMBL15245088 0.86 RHEB (0.55) RHEBDGAT1SOAT1KCNH2PKN1
SCHEMBL3335014 0.86 ALDH1A1 (0.61) RHEBKDM4EALDH1A1HPGDKMT2A
SCHEMBL20535350 0.84 RHEB (1.00) RHEBDGAT1SOAT1KCNH2PKN1
SCHEMBL1662876 0.82 RHEB (0.63) RHEBDGAT1SOAT1KCNH2PKN1
SCHEMBL3341423 0.82 PKN1 (0.72) RHEBDGAT1SOAT1KCNH2PKN1
SCHEMBL15245087 0.80 CYP11B2 (0.52) RHEBDGAT1SOAT1KCNH2KDM4E

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
EP-0511187-B1 Process for the preparation of 1H-benzimidazoles UCB SA (BE) 1996-11-20 EP disclosed
EP-0511187-A1 Process for the preparation of 1H-benzimidazoles U C B, S.A. (BE) 1992-10-28 EP disclosed