SCHEMBL8741109

SCHEMBL8741109

C=Cc1c(CCCCCCC)ccc2cc3ccccc3cc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.43
THRB P10828 1/20 0.43
MAPT P10636 4/20 0.42
TLR8 Q9NR97 4/20 0.40
LIPG Q9Y5X9 1/20 0.40
CYP3A4 P08684 2/20 0.39
TSHR P16473 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TYR P14679 2/20 0.39
TP53 P04637 1/20 0.39
ALOX5 P09917 1/20 0.39
ALOX15 P16050 1/20 0.39
HTT P42858 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
USP2 O75604 1/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL29266169 1.00 THRA (0.43) THRATHRBMAPTTLR8LIPG
SCHEMBL8718986 1.00 THRA (0.43) THRATHRBMAPTTLR8LIPG
SCHEMBL29266155 1.00 THRA (0.43) THRATHRBMAPTTLR8LIPG
SCHEMBL8715524 0.99 TLR8 (0.41) THRATHRBMAPTTLR8LIPG
SCHEMBL8717051 0.94 TLR8 (0.40) THRATHRBMAPTTLR8MEN1
SCHEMBL8717783 0.88 GPR84 (0.38) THRBMEN1KMT2AALDH1A1KDM4E
SCHEMBL29497339 0.87 THRA (0.46) THRATHRBMAPTTLR8LIPG
SCHEMBL9572167 0.87 THRA (0.46) THRATHRBMAPTTLR8LIPG
SCHEMBL8712813 0.87 THRA (0.46) THRATHRBMAPTTLR8LIPG
SCHEMBL9572170 0.87 THRA (0.46) THRATHRBMAPTTLR8LIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5648135-A WRITING, ERASING OPTICAL DISKS; NONTOXIC HITACHI CHEMICAL COMPANY, LTD. (JP) 1997-07-15 US disclosed
US-5464673-A Information recording medium having recording layer with organic polymer and dye contained therein HITACHI CHEMICAL CO., LTD. (JP) 1995-11-07 US disclosed
EP-0527454-A1 Information recording medium having recording layer with organic polymer and dye contained therein Hitachi Chemical Co., Ltd. (JP) 1993-02-17 EP disclosed