SCHEMBL4525985

SCHEMBL4525985

CS(=O)(=O)Nc1ccccc1N1CCN(C(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)Cc2ccccc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MC4R P32245 11/20 0.60
LMNA P02545 1/20 0.59
GLA P06280 1/20 0.59
TSHR P16473 1/20 0.59
TACR1 P25103 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.55
ALDH1A1 P00352 1/20 0.55
KDM4E B2RXH2 1/20 0.55
NPBWR1 P48145 1/20 0.52
MCHR1 Q99705 1/20 0.52
CCR1 P32246 1/20 0.51

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
SCHEMBL4532240 0.90 TACR1 (0.54) MC4RLMNAGLATSHRTACR1
SCHEMBL4520314 0.89 MC4R (0.53) MC4RLMNAGLATSHRTACR1
SCHEMBL4733382 0.89 MC4R (0.54) MC4RLMNAGLATSHRTACR1
SCHEMBL4519231 0.89 MC4R (0.54) MC4RLMNAGLATSHRTACR1
SCHEMBL4519175 0.89 MC4R (0.59) MC4RLMNAGLATSHRTACR1
SCHEMBL4521067 0.88 TACR1 (0.54) MC4RLMNAGLATSHRTACR1
SCHEMBL4505547 0.87 LMNA (0.56) MC4RLMNAGLATSHRTACR1
SCHEMBL4517272 0.87 TACR1 (0.68) MC4RLMNAGLATSHRTACR1
SCHEMBL4521308 0.87 TACR1 (0.51) MC4RLMNAGLATSHRTACR1
SCHEMBL4509742 0.87 TACR1 (0.51) MC4RLMNAGLATSHRTACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070265248-A1 Substituted piperazines and methods of use AMGEN INC. (US) 2007-11-15 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 2/4885LMNA 3009/4885GLA 2785/4885
US-20070265248-A1 Substituted piperazines and methods of use MC5R, MC4R, MC1R MC4R 2/4885LMNA 3009/4885GLA 2785/4885

“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.