SCHEMBL7560820

SCHEMBL7560820

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

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.39
ELANE P08246 3/20 0.39
NAMPT P43490 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38
KCNK3 O14649 2/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
SLC9A1 P19634 1/20 0.38
CYP2C19 P33261 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
ADORA2A P29274 2/20 0.37
P2RY12 Q9H244 1/20 0.36
F2 P00734 1/20 0.35
F10 P00742 1/20 0.35
ITGB3 P05106 1/20 0.35
ITGA2B P08514 1/20 0.35
CCKBR P32239 1/20 0.35

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
SCHEMBL7563530 0.86 F10 (0.44) ROCK2TAAR1F2F10ITGB3
Hydrochloric Acid SCHEMBL7566790 0.85 F10 (0.44) ROCK2TAAR1F2F10ITGB3
SCHEMBL6350201 0.82 ROCK2 (0.42) ROCK2NAMPTKCNK3KDM4EALDH1A1
SCHEMBL6554526 0.80 NAMPT (0.43) ROCK2NAMPTKCNK3ADORA2AITGB3
SCHEMBL6554528 0.80 NAMPT (0.43) NAMPTKCNK3ALDH1A1LMNAADORA2A
SCHEMBL7562491 0.78 TAAR1 (0.38) ROCK2NAMPTTAAR1KCNK3KDM4E
SCHEMBL6556848 0.76 F10 (0.48) ROCK2F2F10ITGB3ITGA2B
Hydrochloric Acid SCHEMBL6554772 0.75 F10 (0.47) ROCK2F2F10ITGB3ITGA2B
SCHEMBL7566309 0.75 F10 (0.49) ROCK2F2F10ITGB3ITGA2B
SCHEMBL7564090 0.74 F10 (0.47) F2F10ITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 ROCK2 2609/4885ELANE 188/4885NAMPT 2476/4885

“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.