SCHEMBL68650

SCHEMBL68650

O=C(NCC(=O)N1CCC(Nc2ccccc2Cl)CC1)c1cc(-c2ccccc2OCc2ccccc2)[nH]n1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SCD O00767 11/20 0.46
KMT2A Q03164 2/20 0.43
KDM5A P29375 1/20 0.43
MEN1 O00255 1/20 0.38
PPIA P62937 1/20 0.37

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
SCHEMBL70227 0.89 SCD (0.55) SCD
SCHEMBL29385122 0.89 SCD (0.43) SCDKMT2AKDM5AMEN1
SCHEMBL69930 0.89 SCD (0.43) SCDKMT2AKDM5AMEN1
SCHEMBL92228 0.89 P2RY12 (0.41) SCDKMT2AKDM5A
SCHEMBL69435 0.87 SCD (0.45) SCDKMT2AMEN1
SCHEMBL69761 0.87 SCD (0.42) SCDKMT2AKDM5A
SCHEMBL70754 0.86 KMT2A (0.41) SCDKMT2AKDM5AMEN1
SCHEMBL29385518 0.86 KMT2A (0.41) SCDKMT2AKDM5AMEN1
SCHEMBL29385005 0.85 KMT2A (0.41) SCDKMT2AKDM5A
SCHEMBL68350 0.85 KMT2A (0.41) SCDKMT2AKDM5A

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
US-8129376-B2 Piperidine derivatives as inhibitors of stearoyl-CoA desaturase AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2012-03-06 US disclosed
EP-2268143-A2 NOVEL PIPERIDINE DERIVATIVES AS INHIBITORS OF STEAROYL-COA DESATURASE Forest Laboratories Holdings Limited (BM) 2011-01-05 EP disclosed
US-20090239810-A1 NOVEL PIPERAZINE DERIVATIVES AS INHIBITORS OF STEAROYL-CoA DESATURASE FOREST LABORATORIES HOLDINGS LIMITED (BM) 2009-09-24 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-20090239810-A1 NOVEL PIPERAZINE DERIVATIVES AS INHIBITORS OF STEAROYL-CoA DESATURASE SCD, SCD5, FADS2 SCD 1/4885KMT2A 1352/4885KDM5A 210/4885

“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.