SCHEMBL732037

SCHEMBL732037

O=C1OC[C@H](Cc2ccccc2)N1C(=O)[C@H]1CN(Cc2ccccc2)C[C@@H]1c1ccc(Cl)cn1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCD5 Q86SK9 1/20 0.39
DRD2 P14416 2/20 0.38
DRD3 P35462 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
MC4R P32245 6/20 0.36
RORC P51449 1/20 0.36
IDH1 O75874 3/20 0.35
FAAH O00519 2/20 0.35
ATM Q13315 1/20 0.34
S1PR5 Q9H228 1/20 0.34

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
SCHEMBL733087 1.00 SCD5 (0.39) SCD5DRD2DRD3ALDH1A1MAOA
SCHEMBL1971832 0.90 DRD2 (0.39) DRD2DRD3RORCIDH1FAAH
SCHEMBL751717 0.90 SCD5 (0.38) SCD5DRD2DRD3ALDH1A1MAOA
SCHEMBL1969732 0.90 DRD2 (0.39) DRD2DRD3RORCIDH1FAAH
SCHEMBL1920901 0.87 RORC (0.47) DRD2DRD3MC4RRORCATM
SCHEMBL1971383 0.87 RORC (0.47) DRD2DRD3MC4RRORCATM
SCHEMBL1971708 0.87 RORC (0.47) DRD2DRD3MC4RRORCATM
SCHEMBL13493089 0.87 SCD5 (0.37) SCD5MC4RIDH1FAAH
SCHEMBL12560887 0.87 SCD5 (0.37) SCD5MC4RIDH1FAAH
SCHEMBL18482300 0.87 SCD5 (0.37) SCD5MC4RIDH1FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1989196-B1 PIPERIDINOYLPYRROLIDINES AS MELANOCORTIN TYPE 4 RECEPTOR AGONISTS PFIZER LTD (GB) 2013-02-13 EP disclosed
US-8138188-B2 Melanocortin type 4 receptor agonist piperidinoylpyrrolidines PFIZER INC. (US) 2012-03-20 US disclosed
US-20090036459-A1 Melanocortin Type 4 Receptor Agonist Piperidinoylpyrrolidines PFIZER INC 2009-02-05 US disclosed
US-20080269233-A1 Piperidinoyl-Pyrrolidine and Piperidinoyl-Piperidine Compounds ANDREWS MARK DAVID 2008-10-30 US disclosed
EP-1912968-A1 PIPERIDINOYL-PYRROLIDINE AND PIPERIDINOYL-PIPERIDINE COMPOUNDS Pfizer Limited (GB) 2008-04-23 EP disclosed
WO-2007015162-A1 PIPERIDINOYL-PYRROLIDINE AND PIPERIDINOYL-PIPERIDINE COMPOUNDS PFIZER LIMITED (GB) 2007-02-08 WO 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 (2 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-20090036459-A1 Melanocortin Type 4 Receptor Agonist Piperidinoylpyrrolidines MC4R, MC5R, MC3R SCD5 2438/4885DRD2 298/4885DRD3 262/4885
US-20080269233-A1 Piperidinoyl-Pyrrolidine and Piperidinoyl-Piperidine Compounds GPR4, GPR119, PRLHR SCD5 3041/4885DRD2 334/4885DRD3 260/4885

“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.