SCHEMBL29327356

SCHEMBL29327356

C[C@@H]1CC(C(=O)[C@H]2CN(c3cccnn3)C[C@@H]2c2ccc(F)cc2F)C[C@H](C)N1c1ccc(F)cc1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MC4R P32245 19/20 0.60
MC3R P41968 9/20 0.58
MC1R Q01726 4/20 0.57
KCNH2 Q12809 5/20 0.46
MC5R P33032 4/20 0.46
DPP4 P27487 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
DPP9 Q86TI2 1/20 0.39

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
SCHEMBL29327357 1.00 MC4R (0.60) MC4RMC3RMC1RKCNH2MC5R
SCHEMBL29327112 0.87 MC4R (0.73) MC4RMC3RMC1RKCNH2MC5R
SCHEMBL29327000 0.87 MC4R (0.73) MC4RMC3RMC1RKCNH2MC5R
SCHEMBL29327113 0.87 MC4R (0.73) MC4RMC3RMC1RKCNH2MC5R
SCHEMBL29327402 0.85 MC4R (0.49) MC4RMC3RMC1RKCNH2MC5R
SCHEMBL29327400 0.85 MC4R (0.49) MC4RMC3RMC1RKCNH2MC5R
SCHEMBL13493103 0.81 MC4R (0.67) MC4RMC3RMC1RKCNH2MC5R
SCHEMBL29327373 0.81 MC4R (0.67) MC4RMC3RMC1RKCNH2MC5R
SCHEMBL12537050 0.81 MC4R (0.67) MC4RMC3RMC1RKCNH2MC5R
Hydrochloric Acid SCHEMBL4922931 0.80 MC4R (0.66) MC4RMC3RMC1RKCNH2MC5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240238281-A1 PIPERAZINE DERIVATIVES AND APPLICATION THEREOF GUANGZHOU BAIYUNSHAN PHARMACEUTICAL HOLDINGS CO., LTD. BAIYUNSHAN PHARMACEUTICAL GENERAL FACTORY (CN) 2024-07-18 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-20240238281-A1 PIPERAZINE DERIVATIVES AND APPLICATION THEREOF AQP3, SLC6A7, ABCG2 MC4R 2367/4885MC3R 1834/4885MC1R 2787/4885

“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.