SCHEMBL10863545

SCHEMBL10863545

CSc1ccc(CNCCN)o1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 3/20 0.46
▸ MC4R P32245 1/20 0.34
▸ MC5R P33032 1/20 0.34
▸ CA1 P00915 3/20 0.34
▸ CA2 P00918 3/20 0.34
▸ AMY1A P0DUB6 1/20 0.33
▸ USP2 O75604 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ CA12 O43570 3/20 0.31
▸ CA9 Q16790 3/20 0.31
▸ CA4 P22748 2/20 0.31
▸ CA6 P23280 2/20 0.31
▸ CA7 P43166 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
▸ LMNA P02545 3/20 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
SCHEMBL18575565 0.82 CHRM2 (0.52) CHRM2MC4RMC5RCA1CA2
SCHEMBL10864746 0.78 CHRM2 (0.39) CHRM2MC4RMC5RAMY1A
SCHEMBL10864363 0.78 CHRM2 (0.73) CHRM2MC4RMC5RAMY1AHTT
SCHEMBL1169840 0.74 — —
SCHEMBL10862582 0.74 CHRM2 (0.44) CHRM2MC4RMC5RCA1CA2
SCHEMBL26230987 0.74 CHRM2 (0.44) CHRM2MC4RMC5RCA1CA2
SCHEMBL10865003 0.74 CHRM2 (0.41) CHRM2MC4RMC5RCA1CA2
SCHEMBL9216895 0.74 PRMT6 (0.53) CHRM2
SCHEMBL9212508 0.74 CHRM2 (0.45) CHRM2MC4RMC5RCA1CA2
SCHEMBL10864923 0.72 CHRM2 (0.33) CHRM2

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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