SCHEMBL91497

SCHEMBL91497

O=C(NCC(=O)N1CCC(Oc2ccccc2Br)CC1)C1=NOC(c2ccccc2)C1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCD O00767 17/20 0.51
SMN1; SMN2 Q16637 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
SCHEMBL92583 0.85 SMN1; SMN2 (0.39) SCDSMN1; SMN2
SCHEMBL92466 0.82 SCD (0.51) SCDSMN1; SMN2
SCHEMBL92437 0.81 CCR2 (0.40) SMN1; SMN2
SCHEMBL92558 0.78 KMT2A (0.46) SCDSMN1; SMN2
SCHEMBL29384518 0.77 SCD (0.55) SCDSMN1; SMN2
SCHEMBL70472 0.77 SCD (0.55) SCDSMN1; SMN2
SCHEMBL70597 0.76 SCD5 (0.54) SCDSMN1; SMN2
SCHEMBL29385533 0.76 SCD5 (0.54) SCDSMN1; SMN2
SCHEMBL68407 0.76 SCD (0.53) SCDSMN1; SMN2
SCHEMBL92443 0.76 SCD (0.52) SCDSMN1; SMN2

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-8129376-B2 Piperidine derivatives as inhibitors of stearoyl-CoA desaturase AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2012-03-06 US 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 1/4885SMN1; SMN2 3937/4885

“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.