Sugi Predict

Sugi Predict / Compounds / SCHEMBL14345366

SCHEMBL14345366

SCHEMBL14345366

C#Cc1ccc(NC(=O)c2cc(OC)ccc2NC(=O)c2ccc(C(=N)N3CCC(C(=O)OCC)CC3)cc2F)nc1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 10/20 0.63
▸ F10 P00742 11/20 0.51
▸ F2 P00734 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ TP53 P04637 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ ITGB3 P05106 2/20 0.40
▸ ITGA2B P08514 2/20 0.40

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
SCHEMBL14345362 0.93 KCNH2 (0.70) KCNH2F10F2MEN1KMT2A
SCHEMBL14345393 0.91 KCNH2 (0.73) KCNH2F10
SCHEMBL14345290 0.90 KCNH2 (0.52) KCNH2F10MEN1KMT2AMAPT
SCHEMBL14345172 0.89 F10 (0.58) KCNH2F10F2
SCHEMBL5535444 0.89 F10 (0.58) KCNH2F10F2
SCHEMBL14345340 0.89 KCNH2 (0.73) KCNH2F10
SCHEMBL5555114 0.88 F10 (0.57) KCNH2F10F2
SCHEMBL14345194 0.85 KCNH2 (0.86) KCNH2F10F2
SCHEMBL5529646 0.84 KCNH2 (0.51) KCNH2F10F2MEN1KMT2A
SCHEMBL14345187 0.83 KCNH2 (0.86) KCNH2F10

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
US-7312235-B2 Benzamide inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-12-25 — — US disclosed
US-7312235-B2 Benzamide inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-12-25 — — US disclosed
EP-1373194-B1 BENZAMIDE INHIBITORS OF FACTOR Xa MILLENNIUM PHARM INC (US) 2007-08-01 — — EP disclosed