SCHEMBL12593241

SCHEMBL12593241

CCCCCCCCc1cc2oc3cc(C)c(C)cc3c2cc1CCCCCCCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 1/20 0.40
▸ CNR1 P21554 4/20 0.39
▸ CNR2 P34972 4/20 0.39
▸ THRB P10828 1/20 0.38
▸ GPR55 Q9Y2T6 1/20 0.38
▸ MAPT P10636 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ TYR P14679 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ ALOX5 P09917 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ GAA P10253 1/20 0.36

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
SCHEMBL12593239 0.98 CNR1 (0.40) SRCCNR1CNR2THRBGPR55
SCHEMBL12593182 0.90 SRC (0.42) SRCCNR1CNR2THRBGPR55
SCHEMBL13400950 0.90 SRC (0.42) SRCCNR1CNR2THRBGPR55
SCHEMBL14523492 0.90 SRC (0.42) SRCCNR1CNR2THRBGPR55
SCHEMBL16806173 0.90 SRC (0.41) SRCCNR1CNR2MAPTTYR
SCHEMBL12593184 0.88 CNR1 (0.41) SRCCNR1CNR2THRBGPR55
SCHEMBL16807693 0.78 MAPT (0.46) CNR1CNR2GPR55MAPTFPR1
SCHEMBL16807676 0.78 KDM4E (0.39) SRCMAPTSMN1; SMN2TYRMEN1
SCHEMBL9581030 0.78 ALOX5 (0.46) MAPTTYRMEN1TP53CYP3A4
SCHEMBL14092904 0.75 CNR1 (0.33) SRCCNR1CNR2GPR55ALOX5

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-20110121278-A1 SOLUTION COMPOSITION AND POLYMER LIGHT-EMITTING DEVICE SUMITOMO CHEMICAL CO., LTD. (JP) 2011-05-26 — — US disclosed
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