SCHEMBL7408155

SCHEMBL7408155

O=C(/C=C/c1cc2ccc(Cl)cc2s1)N1CCN(Cc2cc3cnccc3[nH]2)CC1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
F10 P00742 11/20 0.51
F2 P00734 2/20 0.51
GPR183 P32249 5/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CCR1 P32246 1/20 0.38
HRH4 Q9H3N8 1/20 0.37
KCNH2 Q12809 1/20 0.37
ENPP2 Q13822 1/20 0.37

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
SCHEMBL7408159 1.00 F10 (0.51) F10F2GPR183MEN1KMT2A
SCHEMBL1653390 0.88 F10 (0.64) F10F2
SCHEMBL1653388 0.88 F10 (0.64) F10F2
SCHEMBL27572994 0.86 F10 (0.47) F10F2HRH4
SCHEMBL1653420 0.85 F10 (0.53) F10F2HRH4
SCHEMBL1385885 0.81 F10 (0.56) F10F2HRH4
SCHEMBL4387736 0.75 F10 (0.67) F10F2
SCHEMBL1652461 0.74 F10 (0.57) F10F2HRH4
SCHEMBL8176619 0.74 ALDH1A1 (0.49) F10GPR183HRH4
SCHEMBL3621255 0.74 ALDH1A1 (0.49) F10GPR183HRH4

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
EP-1051176-A4 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS AVENTIS PHARM PROD INC (US) 2002-06-12 EP disclosed
EP-1051176-A1 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS Aventis Pharmaceuticals Products Inc. (US) 2000-11-15 EP disclosed
WO-1999037304-A1 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 1999-07-29 WO disclosed