SCHEMBL5536664

SCHEMBL5536664

C#Cc1cc(OC)c(N(C=O)c2ccc(C(=C3CCN3)N3CCC3)cc2)c(C(=O)Nc2ccc(Cl)cn2)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F10 P00742 17/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
ALOX15 P16050 1/20 0.39
CYP2C19 P33261 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
KCNH2 Q12809 2/20 0.37
KDM4E B2RXH2 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
SCHEMBL5532038 0.92 F10 (0.40) F10KCNH2
SCHEMBL5549885 0.91 KCNH2 (0.39) F10NPC1RAB9ATP53CYP1A2
SCHEMBL5531576 0.86 FGFR4 (0.35) F10NPC1RAB9ATP53SMN1; SMN2
SCHEMBL5535212 0.83 KCNH2 (0.39) F10KCNH2
SCHEMBL5530384 0.82 F10 (0.44) F10KCNH2
SCHEMBL5550016 0.82 NPC1 (0.41) F10NPC1RAB9ATP53CYP1A2
SCHEMBL5552996 0.80 KCNH2 (0.49) F10KCNH2
SCHEMBL5549369 0.78 RAB9A (0.43) F10NPC1RAB9ATP53CYP1A2
SCHEMBL7013030 0.77 F10 (0.31) F10
SCHEMBL5555185 0.74 NPC1 (0.40) F10NPC1RAB9ATP53CYP1A2

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
EP-1373194-B1 BENZAMIDE INHIBITORS OF FACTOR Xa MILLENNIUM PHARM INC (US) 2007-08-01 EP disclosed
US-20030069250-A1 Benzamide inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. 2003-04-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030069250-A1 Benzamide inhibitors of factor Xa SERPINC1, TFPI, F12 F10 10/4885NPC1 2635/4885RAB9A 1933/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.