SCHEMBL92437

SCHEMBL92437

CN(c1ccccc1Br)C1CCN(C(=O)CNC(=O)C2=NOC(c3ccccc3)C2)CC1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 2/20 0.39
ALDH1A1 P00352 1/20 0.39
KDM1A O60341 2/20 0.38
MAOA P21397 2/20 0.38
MAOB P27338 2/20 0.38
FAAH O00519 2/20 0.37
THRA P10827 1/20 0.37
VDR P11473 1/20 0.37
RAB9A P51151 1/20 0.36
LDHA P00338 1/20 0.35
EGLN1 Q9GZT9 1/20 0.35
MAPT P10636 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
SCHEMBL92583 0.82 SMN1; SMN2 (0.39) CCR2SMN1; SMN2KMT2ALMNAFAAH
SCHEMBL91497 0.81 SCD (0.51) SMN1; SMN2
SCHEMBL29384697 0.78 SMN1; SMN2 (0.51) CCR2SMN1; SMN2KMT2ALMNAALDH1A1
SCHEMBL69742 0.78 SMN1; SMN2 (0.51) CCR2SMN1; SMN2KMT2ALMNAALDH1A1
SCHEMBL69708 0.76 HIF1A (0.50) SMN1; SMN2KMT2ALMNAFAAHRAB9A
SCHEMBL29382088 0.76 HIF1A (0.50) SMN1; SMN2KMT2ALMNAFAAHRAB9A
SCHEMBL92558 0.75 KMT2A (0.46) CCR2SMN1; SMN2KMT2ALMNAFAAH
SCHEMBL92443 0.75 SCD (0.52) CCR2SMN1; SMN2
SCHEMBL13983846 0.73 SCD (0.47)
SCHEMBL13708675 0.73 TSHR (0.43) LMNA

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 CCR2 1423/4885SMN1; SMN2 3937/4885KMT2A 1352/4885

“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.