SCHEMBL29610489

SCHEMBL29610489

Nc1ccc(-c2ccccc2-c2ccccc2-c2ccccc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.70
CYP3A4 P08684 3/20 0.70
TDP1 Q9NUW8 2/20 0.70
TAAR1 Q96RJ0 1/20 0.70
ALDH1A1 P00352 7/20 0.56
NCOA1 Q15788 1/20 0.55
NCOA3 Q9Y6Q9 1/20 0.55
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50
HPGD P15428 3/20 0.48
MAPT P10636 2/20 0.48
KDM4E B2RXH2 2/20 0.48
GLA P06280 1/20 0.48
ALOX15 P16050 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
PTGS2 P35354 1/20 0.45

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
SCHEMBL20714939 1.00 HSD17B10 (0.70) HSD17B10CYP3A4TDP1TAAR1ALDH1A1
SCHEMBL9217300 0.97 HSD17B10 (0.74) HSD17B10CYP3A4TDP1TAAR1ALDH1A1
SCHEMBL25301802 0.95 HSD17B10 (0.79) HSD17B10CYP3A4TDP1TAAR1ALDH1A1
SCHEMBL28164997 0.95 HSD17B10 (0.79) HSD17B10CYP3A4TDP1TAAR1ALDH1A1
SCHEMBL30416624 0.95 HSD17B10 (0.79) HSD17B10CYP3A4TDP1TAAR1ALDH1A1
SCHEMBL13941274 0.95 HSD17B10 (0.60) HSD17B10CYP3A4TDP1TAAR1ALDH1A1
SCHEMBL29948076 0.95 HSD17B10 (0.60) HSD17B10CYP3A4TDP1TAAR1ALDH1A1
SCHEMBL9246341 0.92 HSD17B10 (0.63) HSD17B10CYP3A4TDP1TAAR1ALDH1A1
SCHEMBL29118206 0.89 HSD17B10 (0.68) HSD17B10CYP3A4TDP1TAAR1ALDH1A1
SCHEMBL30208583 0.89 HSD17B10 (0.68) HSD17B10CYP3A4TDP1TAAR1ALDH1A1

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-4195304-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT Hodogaya Chemical Co., Ltd. (JP) 2023-06-14 EP disclosed
WO-2022080490-A1 ARYLAMINE COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 保土谷化学工業株式会社 2022-04-21 WO disclosed