SCHEMBL3368156

SCHEMBL3368156

O=C(Cn1c(OC(=O)Nc2ccc(N3CCNCC3=O)cc2)nc2ccccc21)Nc1ccc(Cl)cn1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F10 P00742 2/20 0.50
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 2/20 0.41
LMNA P02545 1/20 0.41
MAPKAPK2 P49137 1/20 0.41
KDR P35968 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL1381365 0.87 F10 (0.66) F10MEN1KMT2AALDH1A1KDM4E
SCHEMBL3372955 0.87 F10 (0.50) F10MEN1KMT2AALDH1A1KDM4E
SCHEMBL3371388 0.85 F10 (0.51) F10MEN1KMT2AALDH1A1KDM4E
SCHEMBL3373371 0.82 F10 (0.56) F10MEN1KMT2AALDH1A1KDM4E
SCHEMBL3372771 0.82 F10 (0.51) F10MEN1KMT2AALDH1A1KDM4E
SCHEMBL3369053 0.81 F10 (0.57) F10MEN1KMT2AALDH1A1KDM4E
SCHEMBL3369686 0.80 F10 (0.76) F10MEN1KMT2AALDH1A1KDM4E
SCHEMBL3371273 0.75 F10 (0.46) F10
SCHEMBL1378964 0.74 F10 (0.66) F10KDR
SCHEMBL3370292 0.73 F10 (0.49) F10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1636216-B1 BENZIMIDAZOLE-DERIVATIVES AS FACTOR Xa INHIBITORS SANOFI AVENTIS DEUTSCHLAND (DE) 2010-07-21 EP claimed