Sugi Predict

Sugi Predict / Compounds / Benzamide

Benzamide

Benzamide

SCHEMBL7364697

CCC(CC(=O)O)c1cccc(C(=N)N)c1.NC(=O)c1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 15/20 0.55
▸ F2 P00734 17/20 0.49
▸ PRSS1 P07477 10/20 0.49
▸ TMPRSS6 Q8IU80 3/20 0.41

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
Trifluoroacetic Acid SCHEMBL8346838 0.94 F10 (0.53) F10F2PRSS1TMPRSS6
Methyl Benzoate SCHEMBL7560351 0.89 F2 (0.55) F10F2PRSS1TMPRSS6
Benzamidine SCHEMBL7366537 0.88 F10 (0.67) F10F2PRSS1
Trifluoroacetic Acid SCHEMBL7463474 0.86 F2 (0.54) F10F2PRSS1TMPRSS6
4-Methylbenzoic Acid Methyl Ester SCHEMBL8350198 0.84 F2 (0.54) F10F2PRSS1TMPRSS6
Methyl Benzoate SCHEMBL7359033 0.82 F10 (0.61) F10F2PRSS1
Trifluoroacetic Acid SCHEMBL8347672 0.82 F2 (0.54) F10F2PRSS1TMPRSS6
4-Methylbenzimidamide SCHEMBL7357637 0.81 F10 (0.65) F10F2PRSS1
SCHEMBL7366288 0.81 F10 (0.64) F10F2PRSS1
SCHEMBL7456785 0.81 F10 (0.71) F10F2PRSS1

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-0892780-B1 M-AMIDINO PHENYL ANALOGS AS FACTOR Xa INHIBITORS BRISTOL MYERS SQUIBB PHARMA CO (US) 2002-11-20 — — EP disclosed
EP-0892780-A1 M-AMIDINO PHENYL ANALOGS AS FACTOR Xa INHIBITORS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1999-01-27 — — EP disclosed
WO-1997030971-A1 M-AMIDINO PHENYL ANALOGS AS FACTOR Xa INHIBITORS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1997-08-28 — — WO disclosed