SCHEMBL4529533

SCHEMBL4529533

CS(=O)(=O)Nc1ccccc1N1CCN(C(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)c2cccnc2)CC1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MC4R P32245 12/20 0.63
MC5R P33032 2/20 0.63
MC3R P41968 2/20 0.63
TSHR P16473 3/20 0.56
USP2 O75604 1/20 0.56
ABL1 P00519 1/20 0.56
RIN1 Q13671 1/20 0.56
ALDH1A1 P00352 2/20 0.51
TACR1 P25103 1/20 0.48
LMNA P02545 1/20 0.47
GLA P06280 1/20 0.47
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
NPY5R Q15761 1/20 0.46
KDM4E B2RXH2 1/20 0.45
ALOX15 P16050 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL4520256 0.92 MC4R (0.54) MC4RMC5RMC3RTSHRUSP2
SCHEMBL4519175 0.91 MC4R (0.59) MC4RMC5RMC3RTSHRALDH1A1
SCHEMBL4521867 0.87 CYP1A2 (0.58) MC4RMC5RMC3RTSHRALDH1A1
SCHEMBL4519377 0.86 MC4R (0.55) MC4RMC5RMC3RTSHRALDH1A1
SCHEMBL4521213 0.85 MC4R (0.54) MC4RMC5RMC3RTSHRALDH1A1
SCHEMBL4531426 0.85 TACR1 (0.59) MC4RMC5RMC3RTSHRALDH1A1
SCHEMBL4514754 0.85 MC4R (0.56) MC4RMC5RMC3RTSHRALDH1A1
SCHEMBL4525299 0.85 MC4R (0.54) MC4RMC5RMC3RTSHRTACR1
SCHEMBL4521394 0.84 MC4R (0.72) MC4RMC5RMC3RTSHRALDH1A1
SCHEMBL4513687 0.84 TACR1 (0.53) MC4RTSHRALDH1A1TACR1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1417190-B1 SUBSTITUTED PIPERAZINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR AMGEN INC (US) 2008-10-22 EP claimed
US-20070265248-A1 Substituted piperazines and methods of use AMGEN INC. (US) 2007-11-15 US claimed
US-7115607-B2 Substituted piperazinyl amides and methods of use AMGEN INC. (US) 2006-10-03 US claimed
US-20030220324-A1 Substituted piperazines and methods of use AMGEN INC. 2003-11-27 US claimed
US-7560460-B2 Substituted piperazines and methods of use AMGEN INC. (US) 2009-07-14 US disclosed
US-7560460-B2 Substituted piperazines and methods of use AMGEN INC. (US) 2009-07-14 US disclosed
US-7560460-B2 Substituted piperazines and methods of use AMGEN INC. (US) 2009-07-14 US disclosed
EP-1417190-B1 SUBSTITUTED PIPERAZINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR AMGEN INC (US) 2008-10-22 EP disclosed
US-20070265248-A1 Substituted piperazines and methods of use AMGEN INC. (US) 2007-11-15 US disclosed
US-20070265248-A1 Substituted piperazines and methods of use AMGEN INC. (US) 2007-11-15 US disclosed
US-20070265248-A1 Substituted piperazines and methods of use AMGEN INC. (US) 2007-11-15 US disclosed
US-7115607-B2 Substituted piperazinyl amides and methods of use AMGEN INC. (US) 2006-10-03 US disclosed
US-20030220324-A1 Substituted piperazines and methods of use AMGEN INC. 2003-11-27 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 (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-20030220324-A1 Substituted piperazines and methods of use MC5R, MC4R, MC1R MC4R 2/4885MC5R 1/4885MC3R 4/4885
US-20070265248-A1 Substituted piperazines and methods of use MC5R, MC4R, MC1R MC4R 2/4885MC5R 1/4885MC3R 4/4885

“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.