SCHEMBL7560641

SCHEMBL7560641

CCOC(=O)CC(NC(=O)c1ccc(C(=O)N2CCCC2)c(C)c1)c1cccc(C(=N)NC(=O)c2ccccc2)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.42
ITGB3 P05106 2/20 0.42
ITGA2B P08514 2/20 0.42
F2 P00734 2/20 0.42
ROCK2 O75116 2/20 0.40
S1PR3 Q99500 4/20 0.39
ROCK1 Q13464 1/20 0.39
LMNA P02545 3/20 0.39
PRSS1 P07477 2/20 0.39
S1PR1 P21453 1/20 0.38
KCNK3 O14649 3/20 0.38
P2RY12 Q9H244 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 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
SCHEMBL6554600 0.95 F10 (0.38) F10ITGB3ITGA2BF2ROCK2
SCHEMBL7564564 0.89 ROCK2 (0.38) F10ITGB3ITGA2BF2ROCK2
SCHEMBL6556848 0.89 F10 (0.48) F10ITGB3ITGA2BF2ROCK2
SCHEMBL6556709 0.88 ALDH1A1 (0.39) F10ITGB3ITGA2BF2ROCK2
Hydrochloric Acid SCHEMBL6554772 0.88 F10 (0.47) F10ITGB3ITGA2BF2ROCK2
SCHEMBL7566309 0.82 F10 (0.49) F10ITGB3ITGA2BF2ROCK2
Hydrochloric Acid SCHEMBL6554519 0.82 F10 (0.48) F10ITGB3ITGA2BF2ROCK2
SCHEMBL7560948 0.82 F10 (0.47) F10ITGB3ITGA2BF2ROCK2
SCHEMBL7560045 0.82 F10 (0.46) F10ITGB3ITGA2BF2ROCK2
Hydrochloric Acid SCHEMBL6554506 0.81 F10 (0.45) F10ITGB3ITGA2BF2ROCK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020151534-A1 Antithrombotic compounds BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-10-17 US claimed
US-20020151534-A1 Antithrombotic compounds BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-10-17 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-20020151534-A1 Antithrombotic compounds SERPINC1, PF4, F2 F10 35/4885ITGB3 108/4885ITGA2B 152/4885

“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.