SCHEMBL6198725

SCHEMBL6198725

NCc1nccn1-c1ccc(NC(=O)c2cc(C(F)(F)F)nn2-c2ccc3onc(N)c3c2)c(F)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 1.00
F2 P00734 17/20 1.00
F9 P00740 2/20 0.84
CTRB1 P17538 2/20 0.84
F5 P12259 1/20 0.84
PROC P04070 1/20 0.83

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
SCHEMBL6197266 0.94 F10 (1.00) F10F2F9CTRB1F5
SCHEMBL5376245 0.93 F10 (1.00) F10F2F9CTRB1F5
SCHEMBL6503086 0.93 F10 (1.00) F10F2F9CTRB1F5
Razaxaban SCHEMBL29376499 0.91 F10 (1.00) F10F2F9CTRB1F5
Razaxaban SCHEMBL677372 0.91 F10 (1.00) F10F2F9CTRB1F5
Razaxaban SCHEMBL29456625 0.91 F10 (1.00) F10F2F9CTRB1F5
Razaxaban SCHEMBL6885838 0.91 F10 (1.00) F10F2F9CTRB1F5
SCHEMBL12589578 0.90 F10 (1.00) F10F2F9CTRB1F5
SCHEMBL5384478 0.90 F10 (1.00) F10F2F9CTRB1F5
SCHEMBL6493125 0.90 F10 (0.88) F10F2F9CTRB1F5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1460996-A4 NOVEL-N-4-(1H-IMIDAZOL-1-YL)-2-FLUOROPHENYL]-3-(TRIFLUOROMETHYL)-1-H-PYRAZOLE-5-CARBOXAMIDES AS FACTOR XA BRISTOL MYERS SQUIBB CO (US) 2005-11-16 EP disclosed
EP-1460996-A2 NOVEL-N-4-(1H-IMIDAZOL-1-YL)-2-FLUOROPHENYL]-3-(TRIFLUOROMETHYL)-1-H-PYRAZOLE-5-CARBOXAMIDES AS FACTOR XA Bristol-Myers Squibb Company (US) 2004-09-29 EP disclosed
US-6730689-B2 HETEROCYCLIC AMIDES SUCH AS N-(4-(2-(((METHYL)AMINO)METHYL)-1H-IMIDAZOL-1-YL)-2-FLUOROPHENYL)-1-(3-AMINO-1,2-BENZISOXAZOL-5-YL)-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-5-CARBOXAMIDE, USED AS ANTICOAGULANTS; PROPHYLAXIS OF CARDIOVASCULAR DISORDERS BRISTOL-MYERS SQUIBB COMPANY 2004-05-04 US disclosed
US-20030144287-A1 Novel N-[4- (1H-imidazol-1-yl) -2-fluorophenyl ] -3- (trifluoromethyl) -1H-pyrazole-5-carboxamides as factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY 2003-07-31 US disclosed
WO-2003047517-A2 NOVEL-N-[4-(1H-IMIDAZOL-1-YL)-2-FLUOROPHENYL]-3-(TRIFLUOROMETHYL)-1-H-PYRAZOLE-5-CARBOXAMIDES AS FACTOR XA BRISTOL-MYERS SQUIBB COMPANY (US) 2003-06-12 WO 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-20030144287-A1 Novel N-[4- (1H-imidazol-1-yl) -2-fluorophenyl ] -3- (trifluoromethyl) -1H-pyrazole-5-carboxamides as factor Xa inhibitors F11, SERPINC1, TFPI F10 8/4885F2 9/4885F9 11/4885

“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.