SCHEMBL10483968

SCHEMBL10483968

NCCNCc1cnc(F)cc1F

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 1/20 0.34
▸ MC5R P33032 1/20 0.34
▸ USP28 Q96RU2 1/20 0.33
▸ CHRM2 P08172 1/20 0.33
▸ LOXL2 Q9Y4K0 1/20 0.32
▸ SCN8A Q9UQD0 1/20 0.31
▸ MPO P05164 2/20 0.31
▸ SLC6A4 P31645 1/20 0.31
▸ CA12 O43570 2/20 0.31
▸ CA6 P23280 2/20 0.31
▸ CA7 P43166 2/20 0.31
▸ CA9 Q16790 2/20 0.31
▸ CA14 Q9ULX7 2/20 0.31
▸ CA5B Q9Y2D0 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ CA2 P00918 2/20 0.31
▸ CA4 P22748 2/20 0.31
▸ MC1R Q01726 1/20 0.30

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
SCHEMBL10862494 0.85 SIGMAR1 (0.35) MC4RMC5RCHRM2MEN1KMT2A
SCHEMBL10483979 0.79 MC1R (0.38) MC4RMC5RCHRM2SCN8AMPO
SCHEMBL10483918 0.79 STK17A (0.36) MC4RMC5RCHRM2MEN1KMT2A
SCHEMBL29605115 0.73 CA12 (0.50) MC4RMC5RCHRM2CA12CA6
SCHEMBL5833046 0.71 MC4R (0.45) MC4RMC5RCHRM2SCN8A
SCHEMBL14303982 0.70 ACHE (0.52) MC4RMC5RCHRM2MPOSLC6A4
SCHEMBL10863825 0.70 SIGMAR1 (0.37) MC4RMC5RCHRM2LOXL2
SCHEMBL10483895 0.70 LOXL2 (0.59) MC4RMC5RCHRM2LOXL2SCN8A
SCHEMBL10483915 0.70 LMNA (0.33) MC4RMC5RCA12CA6CA7
SCHEMBL5884684 0.69 MC4R (0.42) MC4RMC5RCHRM2SCN8A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4812571-A NITROMETHYLENE COMPOUNDS NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1989-03-14 — — US disclosed
US-4774247-A Nitromethylene derivative insecticides NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1988-09-27 — — US disclosed
US-4678795-A 1-pyridylmethyl-2-nitromethylene-1,3-diazacycloalkane insecticides NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1987-07-07 — — US disclosed
EP-0192060-A1 Heterocyclic compounds NIHON BAYER AGROCHEM K.K. (JP) 1986-08-27 — — EP disclosed
EP-0163855-A1 Nitromethylene derivatives, intermediates, and process for their preparation as insecticides NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1985-12-11 — — EP disclosed
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