SCHEMBL23651920

SCHEMBL23651920

CCCCCCCCc1cc(N(c2ccc(C)cc2)c2c(C)cc(C)cc2C)ccc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.36
HTT P42858 4/20 0.36
MEN1 O00255 3/20 0.36
MAPT P10636 3/20 0.36
KMT2A Q03164 3/20 0.36
TYR P14679 2/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
ALOX5 P09917 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
SPHK2 Q9NRA0 2/20 0.33
LIPG Q9Y5X9 1/20 0.33
PTGS2 P35354 2/20 0.33
TLR8 Q9NR97 1/20 0.32
MCHR1 Q99705 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL22003157 0.92 LIPG (0.38) HTTMEN1MAPTKMT2ATYR
SCHEMBL19996207 0.85 PTGS2 (0.43) TP53CYP3A4LIPGPTGS2KDM4E
SCHEMBL16682984 0.83 PTGS2 (0.44) TP53CYP3A4LIPGPTGS2KDM4E
SCHEMBL16615380 0.80 LPL (0.49) TP53CYP3A4LIPGPTGS2KDM4E
SCHEMBL12313694 0.79 SKP2 (0.46) HTTTP53CYP3A4ALOX15PTGS2
SCHEMBL14981814 0.78 TAAR1 (0.44) TAAR1MEN1KMT2ATSHRALDH1A1
SCHEMBL11241677 0.78 TAAR1 (0.57) TAAR1HTTMEN1MAPTKMT2A
SCHEMBL3892982 0.78 TAAR1 (0.57) TAAR1HTTMEN1MAPTKMT2A
SCHEMBL6549903 0.78 TAAR1 (0.57) TAAR1HTTMEN1MAPTKMT2A
SCHEMBL9699152 0.78 TAAR1 (0.57) TAAR1HTTMEN1MAPTKMT2A

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-3439061-B1 LIGHT-EMITTING ELEMENT SUMITOMO CHEMICAL CO (JP) 2021-07-21 EP disclosed