SCHEMBL4492540

SCHEMBL4492540

O=C(NC1CC(=O)N(c2ccc(N3CCCOCC3)c(Cl)c2)C1)c1ccc(Cl)s1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F10 P00742 15/20 0.62
TP53 P04637 2/20 0.47
ENPP2 Q13822 1/20 0.46
LMNA P02545 1/20 0.45
ABCB11 O95342 1/20 0.45
F2 P00734 1/20 0.45
ST14 Q9Y5Y6 1/20 0.45
POLB P06746 1/20 0.44

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
SCHEMBL4492374 0.91 F10 (0.52) F10TP53ENPP2LMNAPOLB
SCHEMBL4505024 0.91 F10 (0.54) F10TP53ENPP2LMNAF2
SCHEMBL4506434 0.88 F10 (0.57) F10ABCB11F2ST14
SCHEMBL4504908 0.87 F10 (0.53) F10TP53LMNA
SCHEMBL4506998 0.86 F10 (0.53) F10TP53LMNAF2
SCHEMBL4496530 0.85 F10 (0.56) F10TP53LMNA
SCHEMBL4506177 0.83 F10 (0.54) F10TP53ENPP2LMNAF2
SCHEMBL4517821 0.82 F10 (0.56) F10ABCB11F2ST14
SCHEMBL4492429 0.82 LMNA (0.50) F10TP53ENPP2LMNA
SCHEMBL4503769 0.81 F10 (0.58) F10ABCB11F2ST14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7615549-B2 Substituted pyrrolidinones, their manufacture and their use as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-11-10 US disclosed
US-7615549-B2 Substituted pyrrolidinones, their manufacture and their use as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-11-10 US disclosed
US-7615549-B2 Substituted pyrrolidinones, their manufacture and their use as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-11-10 US disclosed
US-20060142263-A1 NEW SUBSTITUTED PYRROLIDINONES, THEIR MANUFACTURE AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-06-29 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-20060142263-A1 NEW SUBSTITUTED PYRROLIDINONES, THEIR MANUFACTURE AND THEIR USE AS MEDICAMENTS PYCR1, OAT, UROD F10 814/4885TP53 3367/4885ENPP2 2208/4885

“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.