SCHEMBL734281

SCHEMBL734281

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

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
USP30 Q70CQ3 1/20 0.43
S1PR5 Q9H228 1/20 0.41
RORC P51449 1/20 0.41

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
SCHEMBL731368 0.88 ALDH1A1 (0.47) ALDH1A1MAOAMAOBS1PR5RORC
Hydrochloric Acid SCHEMBL731618 0.86 ALDH1A1 (0.46) ALDH1A1MAOAMAOBS1PR5RORC
SCHEMBL2782125 0.83 RORC (0.56) RORC
SCHEMBL1920333 0.83 RORC (0.56) RORC
SCHEMBL2778336 0.83 RORC (0.56) RORC
SCHEMBL2224784 0.83 RORC (0.56) RORC
SCHEMBL1974665 0.83 RORC (0.56) RORC
SCHEMBL2778339 0.83 RORC (0.56) RORC
SCHEMBL27405331 0.83 RORC (0.56) RORC
SCHEMBL2224788 0.83 RORC (0.56) RORC

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
US-8138188-B2 Melanocortin type 4 receptor agonist piperidinoylpyrrolidines PFIZER INC. (US) 2012-03-20 US 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
US-20080269233-A1 Piperidinoyl-Pyrrolidine and Piperidinoyl-Piperidine Compounds ANDREWS MARK DAVID 2008-10-30 US disclosed
WO-2007096763-A2 MELANOCORTIN TYPE 4 RECEPTOR AGONIST PIPERIDINOYLPYRROLIDINES PFIZER LIMITED (GB) 2007-08-30 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 ALDH1A1 1618/4885MAOA 1310/4885MAOB 1357/4885
US-20080269233-A1 Piperidinoyl-Pyrrolidine and Piperidinoyl-Piperidine Compounds GPR4, GPR119, PRLHR ALDH1A1 590/4885MAOA 3645/4885MAOB 3007/4885

“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.