SCHEMBL69860

SCHEMBL69860

O=C(NCC(=O)N1CCC(Nc2ccccc2Cl)CC1)c1cc(-c2ccccc2)on1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 3/20 0.52
KMT2A Q03164 5/20 0.48
RAB9A P51151 5/20 0.48
NPC1 O15118 4/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
LMNA P02545 3/20 0.48
HPGD P15428 1/20 0.48
USP30 Q70CQ3 1/20 0.47
S1PR1 P21453 1/20 0.47
HTT P42858 1/20 0.46
SCD5 Q86SK9 4/20 0.46
MAPK1 P28482 1/20 0.44
FAAH O00519 1/20 0.44
STAT3 P40763 1/20 0.43
STAT1 P42224 1/20 0.43

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
SCHEMBL29385107 1.00 HIF1A (0.52) HIF1AKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL29385678 0.89 HIF1A (0.52) HIF1AKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL69338 0.89 HIF1A (0.52) HIF1AKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL69611 0.88 KMT2A (0.50) KMT2ARAB9ANPC1SMN1; SMN2LMNA
SCHEMBL29384466 0.88 KMT2A (0.50) KMT2ARAB9ANPC1SMN1; SMN2LMNA
SCHEMBL70424 0.88 ACKR3 (0.51) KMT2ARAB9ANPC1HPGDSCD5
SCHEMBL29382405 0.88 ACKR3 (0.51) KMT2ARAB9ANPC1HPGDSCD5
SCHEMBL68730 0.86 SCD5 (0.53) HIF1AKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL29384705 0.86 SCD5 (0.53) HIF1AKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL69435 0.84 SCD (0.45) KMT2ARAB9ANPC1SMN1; SMN2LMNA

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
EP-2268143-A2 NOVEL PIPERIDINE DERIVATIVES AS INHIBITORS OF STEAROYL-COA DESATURASE Forest Laboratories Holdings Limited (BM) 2011-01-05 EP claimed
US-8129376-B2 Piperidine derivatives as inhibitors of stearoyl-CoA desaturase AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2012-03-06 US disclosed
WO-2009117676-A2 NOVEL PIPERIDINE DERIVATIVES AS INHIBITORS OF STEAROYL-COA DESATURASE FOREST LABORATORIES HOLDINGS LIMITED (BM) 2009-09-24 WO 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 HIF1A 1520/4885KMT2A 1352/4885RAB9A 3858/4885

“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.