SCHEMBL16385673

SCHEMBL16385673

Cc1ccccc1-c1cc(N(c2ccccc2)c2ccc(-c3cccc(-c4ccc(N(c5ccccc5)c5ccc(C)c(-c6ccccc6C)c5)cc4)c3)cc2)ccc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 1/20 0.38
MCL1 Q07820 1/20 0.37
HTR7 P34969 2/20 0.36
TYMS P04818 1/20 0.36
CYP1A2 P05177 2/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2D6 P10635 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 2/20 0.34
MAPT P10636 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
ACMSD Q8TDX5 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL23128250 0.96 DHODH (0.38) SLC6A9MCL1HTR7TYMSCYP1A2
SCHEMBL19881123 0.92 SLC6A9 (0.43) SLC6A9MCL1HTR7TYMSCYP1A2
SCHEMBL26229457 0.92 SLC6A9 (0.43) SLC6A9MCL1HTR7TYMSCYP1A2
SCHEMBL20925361 0.89 MCL1 (0.38) SLC6A9MCL1HTR7CYP1A2CYP3A4
SCHEMBL22524041 0.89 ALDH1A1 (0.42) MCL1HTR7CYP1A2CYP3A4CYP2D6
SCHEMBL22137999 0.89 CYP1A2 (0.36) SLC6A9MCL1CYP1A2CYP3A4CYP2D6
SCHEMBL16272214 0.89 SLC6A9 (0.33) SLC6A9MCL1HTR7TYMSCYP1A2
SCHEMBL19393444 0.88 MCL1 (0.45) SLC6A9MCL1HTR7TYMSCYP1A2
SCHEMBL21944199 0.87 HTR7 (0.46) SLC6A9MCL1HTR7TYMSCYP1A2
SCHEMBL17881830 0.87 MAPT (0.39) SLC6A9MCL1HTR7TYMSCYP1A2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3163644-A1 ORGANIC ELECTROLUMINESCENT ELEMENT Hodogaya Chemical Co., Ltd. (JP) 2017-05-03 EP disclosed
WO-2015004875-A1 ORGANIC ELECTROLUMINESCENT ELEMENT 保土谷化学工業株式会社 (JP) 2015-01-15 WO disclosed