SCHEMBL10864746

SCHEMBL10864746

NCCNCc1ccc(SC(F)(F)F)o1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 2/20 0.39
▸ PTPN1 P18031 1/20 0.35
▸ PTPRZ1 P23471 1/20 0.35
▸ MC4R P32245 1/20 0.32
▸ MC5R P33032 1/20 0.32
▸ AMY1A P0DUB6 1/20 0.32

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
SCHEMBL18575565 0.78 CHRM2 (0.52) CHRM2MC4RMC5RAMY1A
SCHEMBL10863545 0.78 CHRM2 (0.46) CHRM2MC4RMC5RAMY1A
SCHEMBL10863875 0.78 CHRM2 (0.42) CHRM2MC4RMC5RAMY1A
SCHEMBL10864344 0.71 CHRM2 (0.42) CHRM2MC4RMC5RAMY1A
SCHEMBL26230987 0.70 CHRM2 (0.44) CHRM2MC4RMC5RAMY1A
SCHEMBL10864363 0.70 CHRM2 (0.73) CHRM2MC4RMC5RAMY1A
SCHEMBL10862582 0.70 CHRM2 (0.44) CHRM2MC4RMC5RAMY1A
SCHEMBL16250575 0.70 PTPRZ1 (0.73) CHRM2PTPN1PTPRZ1MC4RMC5R
SCHEMBL10865003 0.70 CHRM2 (0.41) CHRM2MC4RMC5RAMY1A
SCHEMBL7993830 0.70 PTPN1 (0.31) PTPN1PTPRZ1

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
EP-0192060-A1 Heterocyclic compounds NIHON BAYER AGROCHEM K.K. (JP) 1986-08-27 — — EP disclosed
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