SCHEMBL13147091

SCHEMBL13147091

N=C(NCCCCCN1CCCCC1)NC(=O)c1cccc(F)c1CCc1cc(Br)cc2ccoc12

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 10/20 0.49
▸ FPR3 P25089 5/20 0.37
▸ FPR2 P25090 5/20 0.37
▸ PHF13 Q86YI8 1/20 0.36
▸ L3MBTL3 Q96JM7 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ PSMD14 O00487 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ SMAD3 P84022 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ PTK2B Q14289 1/20 0.36
▸ HTR3A P46098 1/20 0.35

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
SCHEMBL13147083 0.99 MC4R (0.48) MC4RFPR3FPR2PHF13L3MBTL3
SCHEMBL13147330 0.98 MC4R (0.49) MC4RFPR3FPR2PHF13L3MBTL3
SCHEMBL13147119 0.91 ALDH1A1 (0.45) MC4RL3MBTL1KMT2A
SCHEMBL13147146 0.90 MC4R (0.40) MC4RFPR3FPR2PHF13L3MBTL3
SCHEMBL13147357 0.90 MC4R (0.45) MC4R
SCHEMBL14193791 0.82 MC4R (0.72) MC4R
SCHEMBL13147367 0.81 MC4R (0.73) MC4R
SCHEMBL13147213 0.80 MC4R (0.43) MC4RHTR3A
SCHEMBL3090271 0.79 MC4R (0.72) MC4R
SCHEMBL13147205 0.78 MC4R (0.48) MC4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7790719-B2 Modulators of melanocortin receptor ORE PHARMACEUTICALS, INC. (US) 2010-09-07 — — US disclosed
US-7790719-B2 Modulators of melanocortin receptor ORE PHARMACEUTICALS, INC. (US) 2010-09-07 — — US disclosed
US-7365070-B2 Modulators of melanocortin receptor ORE PHARMACEUTICALS INC. (US) 2008-04-29 — — US disclosed
US-7365070-B2 Modulators of melanocortin receptor ORE PHARMACEUTICALS INC. (US) 2008-04-29 — — US disclosed
US-20070293498-A1 Modulators of melanocortin receptor GENE LOGIC, INC. (US) 2007-12-20 — — US disclosed
US-20070293498-A1 Modulators of melanocortin receptor GENE LOGIC, INC. (US) 2007-12-20 — — 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-20070293498-A1 Modulators of melanocortin receptor MC4R, MC1R, MC5R MC4R 1/4885FPR3 307/4885FPR2 310/4885

“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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