SCHEMBL6285870

SCHEMBL6285870

CC(C)(C)NS(=O)(=O)c1ccccc1-c1ccc(NC(=O)c2sc(Cl)nc2-c2cccc(C#N)c2)nc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 11/20 0.42
FEN1 P39748 11/20 0.42
NPSR1 Q6W5P4 3/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
F2 P00734 1/20 0.38
F10 P00742 1/20 0.38
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
GRM5 P41594 1/20 0.38

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
SCHEMBL6283141 0.92 F2 (0.47) ALOX5APFEN1F2F10PRSS1
SCHEMBL7389491 0.83 F10 (0.45) ALOX5APFEN1F2F10PRSS1
SCHEMBL6166397 0.79 ALOX5AP (0.42) ALOX5APFEN1GRM5
SCHEMBL6287358 0.76 F10 (0.50) NPSR1LMNASMN1; SMN2ALDH1A1F2
SCHEMBL6286596 0.75 F10 (0.65) F2F10PRSS1PRSS2PRSS3
SCHEMBL3834732 0.74 F10 (0.65) F2F10PRSS1PRSS2PRSS3
SCHEMBL6164549 0.73 F10 (0.56) ALOX5APFEN1F2F10PRSS1
SCHEMBL6164560 0.71 ALOX5AP (0.45) ALOX5APFEN1F10
SCHEMBL6166616 0.70 F10 (0.52) ALOX5APFEN1LMNAGAAHTT
SCHEMBL6164546 0.69 CSNK1E (0.43) ALOX5APFEN1

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
US-6962935-B2 Oxygen or sulfur containing heteroaromatics as factor Xa inhibitors BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2005-11-08 US disclosed
US-20040073029-A1 Oxygen or sulfur containing heteroaromatics as factor Xa inhibitors PRUITT JAMES RUSSELL (US) 2004-04-15 US disclosed
US-6569874-B1 Such as 2-acetylamino-4-(3-amidinophenyl)-5-((2'-amino-sulfonyl-(1,1')-biphen-4 -yl)aminocarbonyl)thiazole; for treatment of thromboembolic disorders BRISTOL-MYERS SQUIBB COMPANY 2003-05-27 US disclosed
EP-0946528-B1 OXYGEN OR SULFUR CONTAINING 5-MEMBERED HETEROAROMATICS AS FACTOR Xa INHIBITORS BRISTOL MYERS SQUIBB PHARMA CO (US) 2003-04-09 EP disclosed
US-6187797-B1 ANTICOAGULANTS; TRYPSINE-LIKE SERINE PROTEASE INHIBITORS DUPONT PHARMACEUTICALS COMPANY 2001-02-13 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-20040073029-A1 Oxygen or sulfur containing heteroaromatics as factor Xa inhibitors F12, XDH, F2 ALOX5AP 2392/4885FEN1 1513/4885NPSR1 515/4885

“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.