SCHEMBL10065953

SCHEMBL10065953

C=C(/C=C\C(=C/C)N(c1ccc(C)cc1)c1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccccc3)cc2)cc1)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TRPM8 Q7Z2W7 1/20 0.35
▸ PTGES O14684 1/20 0.32
▸ ALOX5 P09917 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ HPGD P15428 2/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ EPHX1 P07099 1/20 0.31
▸ CES2 O00748 1/20 0.30
▸ CES1 P23141 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
SCHEMBL18506199 0.95 MEN1 (0.34) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL12829856 0.92 MAPT (0.35) ALOX5ALDH1A1MAPTHPGDMEN1
SCHEMBL22294815 0.92 MAPT (0.35) ALOX5ALDH1A1MAPTHPGDMEN1
SCHEMBL19707096 0.86 LTB4R2 (0.35) MAPTHPGDMEN1KMT2ALMNA
SCHEMBL23221626 0.85 ALDH1A1 (0.40) ALDH1A1MAPTMEN1KMT2A
SCHEMBL18801297 0.81 — —
SCHEMBL18533905 0.80 PIN1 (0.35) PTGESALOX5ALDH1A1MEN1KMT2A
SCHEMBL22099639 0.79 — —
SCHEMBL17751427 0.78 — —
SCHEMBL20245042 0.78 KDM4E (0.37) KMT2AKDM4E

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-2423994-A1 Composite material, light emitting element, light emitting device and electronic appliance using the composite material Semiconductor Energy Laboratory Co, Ltd. (JP) 2012-02-29 — — EP disclosed
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