SCHEMBL22003157

SCHEMBL22003157

CCCCCCCc1cc(N(c2ccccc2)c2c(C)cc(C)cc2C)ccc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.38
TLR8 Q9NR97 1/20 0.36
KCNH2 Q12809 1/20 0.35
TYR P14679 2/20 0.34
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
ALOX5 P09917 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
BID P55957 3/20 0.33
MCL1 Q07820 3/20 0.33
BCL2L1 Q07817 2/20 0.33
BAK1 Q16611 2/20 0.33
KAT8 Q9H7Z6 2/20 0.33
STAT3 P40763 1/20 0.33

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
SCHEMBL23651920 0.92 TAAR1 (0.36) LIPGTLR8KCNH2TYRMEN1
SCHEMBL16615380 0.78 LPL (0.49) LIPGKCNH2TP53CYP3A4
SCHEMBL1115692 0.77 L3MBTL1 (0.43) MEN1CYP3A4MAPTTSHRKMT2A
SCHEMBL19996207 0.77 PTGS2 (0.43) LIPGTP53CYP3A4
SCHEMBL15854844 0.76 SKP2 (0.46) KCNH2CYP3A4HTT
SCHEMBL17928941 0.76 SKP2 (0.46) KCNH2CYP3A4HTT
SCHEMBL15861362 0.75 KCNH2 (0.39) LIPGTLR8KCNH2HTTKAT8
SCHEMBL3477723 0.75 CYP1A2 (0.41) MEN1CYP3A4MAPTTSHRHTT
SCHEMBL16682984 0.75 PTGS2 (0.44) LIPGTP53CYP3A4
SCHEMBL2310342 0.74 CYP2C19 (0.42) MEN1TP53CYP3A4MAPTTSHR

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-10654967-B2 Polymer compound and light-emitting element using same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-05-19 US disclosed