SCHEMBL4698179

SCHEMBL4698179

CC(C)(C)OC(=O)N1CCC(CC(=O)N[C@H](Cc2ccc(Cl)cc2)C(=O)N2CCC(c3ccccc3NS(C)(=O)=O)CC2)CC1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
YAP1 P46937 3/20 0.54
TACR1 P25103 1/20 0.50
MC4R P32245 10/20 0.44
P2RX7 Q99572 3/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL4697553 0.89 TACR1 (0.54) TACR1MC4R
SCHEMBL4698174 0.88 TACR1 (0.53) TACR1MC4RP2RX7KMT2A
SCHEMBL4701510 0.87 TACR1 (0.49) TACR1MC4RKMT2A
SCHEMBL4699718 0.87 TACR1 (0.51) TACR1MC4R
SCHEMBL4701845 0.84 TACR1 (0.47) TACR1MC4RKMT2A
SCHEMBL4698287 0.81 TACR1 (0.63) TACR1MC4RP2RX7KMT2A
SCHEMBL4700056 0.81 KMT2A (0.49) TACR1MC4RKMT2A
SCHEMBL4699853 0.81 KMT2A (0.49) TACR1MC4RKMT2A
SCHEMBL4697661 0.80 TACR1 (0.53) TACR1MC4R
SCHEMBL4675927 0.80 GPR119 (0.50) TACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1416933-B1 SUBSTITUTED PIPERIDINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR AMGEM INC (US) 2008-01-02 EP disclosed
US-6977264-B2 Substituted piperidines and methods of use AMGEN INC. (US) 2005-12-20 US disclosed
US-20040006067-A1 Substituted piperidines and methods of use AMGEN INC. 2004-01-08 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-20040006067-A1 Substituted piperidines and methods of use MC4R, MC5R, MC1R YAP1 4021/4885TACR1 48/4885MC4R 1/4885

“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.