SCHEMBL13147119

SCHEMBL13147119

N=C(NCCCN1CCOCC1)NC(=O)c1cccc(F)c1CCc1cc(Br)cc2ccoc12

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.45
▸ MAOA P21397 1/20 0.43
▸ MAOB P27338 1/20 0.43
▸ MC4R P32245 4/20 0.43
▸ BCL3 P20749 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ TSHR P16473 3/20 0.41
▸ POLB P06746 1/20 0.41
▸ KMT2A Q03164 1/20 0.40
▸ L3MBTL1 Q9Y468 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
SCHEMBL13147330 0.92 MC4R (0.49) MC4RKMT2AL3MBTL1
SCHEMBL13147083 0.91 MC4R (0.48) MC4RKMT2AL3MBTL1
SCHEMBL13147091 0.91 MC4R (0.49) MC4RKMT2AL3MBTL1
SCHEMBL13147357 0.87 MC4R (0.45) MC4R
SCHEMBL13147146 0.83 MC4R (0.40) MC4RL3MBTL1
SCHEMBL3077985 0.83 MC4R (0.62) MC4RLMNA
SCHEMBL3080769 0.82 ALDH1A1 (0.52) ALDH1A1MAOAMAOBMC4RBCL3
SCHEMBL13147213 0.80 MC4R (0.43) MC4R
SCHEMBL13147205 0.79 MC4R (0.48) MC4R
SCHEMBL13147198 0.79 MC4R (0.37) ALDH1A1MC4RKMT2A

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 ALDH1A1 2708/4885MAOA 1227/4885MAOB 508/4885

“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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