SCHEMBL6943416

SCHEMBL6943416

CCOC(=O)CC(NC(=O)c1ccc(-n2nc(CN)c3c2CCC3)c(C(F)(F)F)c1)c1cccc(C(=N)N)c1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F10 P00742 6/20 0.41
F2 P00734 5/20 0.41
ITGB3 P05106 2/20 0.41
ITGA2B P08514 2/20 0.41
PRSS1 P07477 2/20 0.39
ROCK2 O75116 2/20 0.36
TAAR1 Q96RJ0 1/20 0.35
THRB P10828 1/20 0.34
PRSS2 P07478 1/20 0.33
PRSS3 P35030 1/20 0.33
CTSL P07711 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
CNR2 P34972 1/20 0.32

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
SCHEMBL6939984 0.91 ROCK2 (0.38) F10F2ITGB3ITGA2BROCK2
SCHEMBL7563382 0.82 F2 (0.43) F10F2ITGB3ITGA2BPRSS1
Hydrochloric Acid SCHEMBL6937677 0.81 F2 (0.43) F10F2ITGB3ITGA2BPRSS1
SCHEMBL7563530 0.77 F10 (0.44) F10F2ITGB3ITGA2BPRSS1
Hydrochloric Acid SCHEMBL7566790 0.76 F10 (0.44) F10F2ITGB3ITGA2BPRSS1
SCHEMBL2998879 0.75 CYP1A2 (0.36) F10PRSS1PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL6941228 0.72 F10 (0.35) F10F2ITGB3ITGA2BPRSS1
SCHEMBL6556848 0.72 F10 (0.48) F10F2ITGB3ITGA2BPRSS1
Hydrochloric Acid SCHEMBL6554772 0.71 F10 (0.47) F10F2ITGB3ITGA2BPRSS1
Hydrochloric Acid SCHEMBL7561461 0.71 ITGB3 (0.40) F10F2ITGB3ITGA2BPRSS1

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-1370540-A1 ANTI-THROMBOTIC CARBOXYLIC ACID AMIDES, THE PRODUCTION THEREOF AND USE OF THE SAME AS MEDICAMENTS Boehringer Ingelheim Pharma GmbH & Co.KG (DE) 2003-12-17 EP disclosed
US-20020183519-A1 Antithrombotic carboxylic acid amides BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-12-05 US disclosed
WO-2002072558-A1 ANTI-THROMBOTIC CARBOXYLIC ACID AMIDES, THE PRODUCTION THEREOF AND USE OF THE SAME AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-09-19 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-20020183519-A1 Antithrombotic carboxylic acid amides SERPINC1, TFPI, F2 F10 33/4885F2 3/4885ITGB3 619/4885

“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.