SCHEMBL24940693

SCHEMBL24940693

COc1cc([C@H](C)C(=O)N2CCCCc3cc(-c4ncccn4)c(C)nc3NC2)cc(OC)n1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 18/20 0.51
▸ MC5R P33032 1/20 0.44
▸ MC3R P41968 1/20 0.44
▸ KCNH2 Q12809 1/20 0.44
▸ HCRTR1 O43613 1/20 0.33
▸ HCRTR2 O43614 1/20 0.33

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
SCHEMBL24940027 0.87 MC4R (0.59) MC4RMC5RMC3RKCNH2
SCHEMBL25586764 0.85 MC4R (0.70) MC4RMC5RMC3RKCNH2
SCHEMBL24940865 0.85 MC4R (0.70) MC4RMC5RMC3RKCNH2
SCHEMBL24940750 0.85 MC4R (0.60) MC4RMC5RMC3RKCNH2
SCHEMBL25587829 0.83 MC4R (0.69) MC4RMC5RMC3RKCNH2HCRTR1
SCHEMBL25588358 0.82 MC4R (0.53) MC4RMC5RMC3RKCNH2
SCHEMBL31139165 0.81 MC4R (0.75) MC4RMC5RMC3RKCNH2
SCHEMBL24940005 0.81 MC4R (0.75) MC4RMC5RMC3RKCNH2
SCHEMBL24094610 0.81 MC4R (0.75) MC4RMC5RMC3RKCNH2
SCHEMBL24940778 0.79 MC4R (0.59) MC4RMC5RMC3RKCNH2

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-20230019853-A1 MELANOCORTIN 4 RECEPTOR ANTAGONISTS AND USES THEREOF PFIZER INC. (US) 2023-01-19 — — 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-20230019853-A1 MELANOCORTIN 4 RECEPTOR ANTAGONISTS AND USES THEREOF MC4R, MC3R, MC5R MC4R 1/4885MC5R 3/4885MC3R 2/4885

“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.

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