SCHEMBL10388450

SCHEMBL10388450

Cc1ccc(O)c(CC(C)c2cccc(C(C)Cc3cc(C)ccc3O)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AMY1A P0DUB6 1/20 0.46
▸ LMNA P02545 3/20 0.43
▸ CHRM1 P11229 3/20 0.43
▸ MAPT P10636 2/20 0.43
▸ ADRA1A P35348 2/20 0.43
▸ CHRM2 P08172 2/20 0.43
▸ CHRM5 P08912 2/20 0.43
▸ CHRM3 P20309 2/20 0.43
▸ HRH1 P35367 2/20 0.43
▸ ESR1 P03372 1/20 0.43
▸ CHRM4 P08173 1/20 0.43
▸ KCNE1 P15382 1/20 0.43
▸ PTGS1 P23219 1/20 0.43
▸ HRH2 P25021 1/20 0.43
▸ HTR2A P28223 1/20 0.43
▸ SLC6A4 P31645 1/20 0.43
▸ OPRK1 P41145 1/20 0.43
▸ KCNQ1 P51787 1/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ CACNA1C Q13936 1/20 0.43

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
SCHEMBL7164202 0.81 HDAC4 (0.49) MAPTHTR2ASLC6A4KCNH2GABRA1
SCHEMBL30477717 0.81 HDAC4 (0.49) MAPTHTR2ASLC6A4KCNH2GABRA1
SCHEMBL3960601 0.78 GABRA1 (0.66) AMY1ALMNACHRM1MAPTADRA1A
SCHEMBL15666913 0.77 AMY1A (0.53) AMY1ALMNACHRM1MAPTADRA1A
SCHEMBL15666912 0.77 AMY1A (0.53) AMY1ALMNACHRM1MAPTADRA1A
SCHEMBL15667381 0.77 AMY1A (0.53) AMY1ALMNACHRM1MAPTADRA1A
SCHEMBL14478234 0.75 AMY1A (0.52) AMY1ALMNACHRM1ADRA1AGABRA1
SCHEMBL9191347 0.75 TYR (0.49) MAPTESR1HTTHDAC4HDAC2
SCHEMBL11193682 0.75 TYR (0.49) ESR1GABRA1GABRB2TRPA1
SCHEMBL23153076 0.74 AMY1A (0.50) AMY1ALMNACHRM1MAPTADRA1A

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
US-4971942-A Colorless basic chromogenic cye, divinyl compound, fluorane-type leuco dye JUJO PAPER CO., LTD. (JP) 1990-11-20 — — US disclosed
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