SCHEMBL4815771

SCHEMBL4815771

COc1ccccc1CCc1c(OC)cccc1C1=NCCCN1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 1/20 0.54
▸ KCNH2 Q12809 1/20 0.54
▸ NISCH Q9Y2I1 3/20 0.40
▸ GAA P10253 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ HRH3 Q9Y5N1 1/20 0.39
▸ TAAR1 Q96RJ0 1/20 0.38
▸ SIGMAR1 Q99720 1/20 0.38
▸ AOC3 Q16853 1/20 0.38
▸ PDCD1LG2 Q9BQ51 1/20 0.37
▸ CD274 Q9NZQ7 1/20 0.37

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
SCHEMBL4373220 0.90 MC4R (0.48) MC4RKCNH2NISCHTAAR1
SCHEMBL4011110 0.87 MC4R (0.73) MC4RKCNH2
SCHEMBL4360835 0.81 NISCH (0.53) MC4RKCNH2NISCH
SCHEMBL4370780 0.81 NISCH (0.48) MC4RKCNH2NISCHGAATSHR
SCHEMBL4016721 0.81 MC4R (0.67) MC4RKCNH2
SCHEMBL4357709 0.80 NISCH (0.47) MC4RKCNH2NISCHGAATSHR
SCHEMBL4364636 0.80 MC4R (0.69) MC4RKCNH2
SCHEMBL4010426 0.80 MC4R (0.66) MC4RKCNH2
SCHEMBL4148768 0.80 MC4R (0.63) MC4RKCNH2
SCHEMBL4823582 0.80 KDM4E (0.41) MC4RKCNH2NISCHGAATSHR

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-20080269217-A1 Melanocortin-4 receptor binding compounds and methods of use thereof ORE PHARMACEUTICALS, INC. (US) 2008-10-30 — — US disclosed
US-20080269217-A1 Melanocortin-4 receptor binding compounds and methods of use thereof ORE PHARMACEUTICALS, INC. (US) 2008-10-30 — — US disclosed
US-20080269217-A1 Melanocortin-4 receptor binding compounds and methods of use thereof ORE PHARMACEUTICALS, INC. (US) 2008-10-30 — — US disclosed
US-7375125-B2 Melanocortin-4 receptor binding compounds and methods of use thereof ORE PHARMACEUTICALS, INC. (US) 2008-05-20 — — US disclosed
US-7375125-B2 Melanocortin-4 receptor binding compounds and methods of use thereof ORE PHARMACEUTICALS, INC. (US) 2008-05-20 — — US disclosed
US-7375125-B2 Melanocortin-4 receptor binding compounds and methods of use thereof ORE PHARMACEUTICALS, INC. (US) 2008-05-20 — — 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-20080269217-A1 Melanocortin-4 receptor binding compounds and methods of use thereof MC4R, MC5R, MC3R MC4R 1/4885KCNH2 3035/4885NISCH 1934/4885

“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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