SCHEMBL6358943

SCHEMBL6358943

NN=CNCCCCC(=O)NCC(=O)NC(Cc1cccnc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.48
PTAFR P25105 2/20 0.45
MAPT P10636 1/20 0.45
CYP3A4 P08684 2/20 0.43
GPR132 Q9UNW8 5/20 0.42
FAAH O00519 4/20 0.42
EPHX2 P34913 2/20 0.40
CMKLR2 P46091 1/20 0.40
CMKLR1 Q99788 1/20 0.40
TBXAS1 P24557 1/20 0.39

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
SCHEMBL6954777 0.99 FOLH1 (0.47) FOLH1PTAFRMAPTCYP3A4GPR132
SCHEMBL6953443 0.90 NLRP3 (0.45) PTAFRMAPTCYP3A4FAAH
SCHEMBL6952538 0.88 FAAH (0.44) FOLH1PTAFRMAPTCYP3A4FAAH
SCHEMBL6949829 0.85 FAAH (0.41) FOLH1PTAFRMAPTCYP3A4FAAH
SCHEMBL6358935 0.85 FOLH1 (0.49) FOLH1PTAFRMAPTCYP3A4GPR132
SCHEMBL6949090 0.81 LMNA (0.45) FOLH1GPR132EPHX2CMKLR2CMKLR1
SCHEMBL4924109 0.81 ITGB3 (0.52) PTAFRTBXAS1
SCHEMBL6947579 0.80 ITGB3 (0.51) PTAFRMAPTCYP3A4TBXAS1
SCHEMBL29538593 0.78 GPR132 (0.50) FOLH1CYP3A4GPR132CMKLR2CMKLR1
SCHEMBL6950494 0.78 ITGB3 (0.51)

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
EP-0804418-B1 PLATELET AGGREGATION INHIBITORS SEARLE & CO (US) 2003-03-26 EP claimed
US-20050043344-A1 Heteroarylalkanoic acids as integrin receptor antagonists derivatives PHARMACIA CORPORATION 2005-02-24 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-20050043344-A1 Heteroarylalkanoic acids as integrin receptor antagonists derivatives ITGA5, ITGAV, ITGA6 FOLH1 2015/4885PTAFR 72/4885MAPT 4206/4885

“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.