SCHEMBL29625618

SCHEMBL29625618

Brc1c(N(c2cccc3ccccc23)c2cccc3ccccc23)cccc1-n1c2ccccc2c2c3ccccc3ccc21

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.35
▸ SIGMAR1 Q99720 1/20 0.34
▸ CNR1 P21554 1/20 0.31
▸ CNR2 P34972 1/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ POLB P06746 1/20 0.30

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
SCHEMBL29625607 0.93 SIGMAR1 (0.33) TDP1SIGMAR1ALDH1A1
SCHEMBL29625604 0.89 TDP1 (0.33) TDP1SIGMAR1
SCHEMBL29625619 0.87 TDP1 (0.32) TDP1
SCHEMBL29625640 0.86 TDP1 (0.41) TDP1SIGMAR1CNR1CNR2ALDH1A1
SCHEMBL29625568 0.85 TDP1 (0.41) TDP1SIGMAR1CNR1CNR2ALDH1A1
SCHEMBL29625611 0.84 — —
SCHEMBL29625570 0.83 SIGMAR1 (0.32) TDP1SIGMAR1
SCHEMBL29625571 0.82 SIGMAR1 (0.34) SIGMAR1ALDH1A1CYP1A2HPGDHSD17B10
SCHEMBL29625613 0.82 ALDH1A1 (0.37) TDP1SIGMAR1CNR1CNR2ALDH1A1
SCHEMBL24374465 0.79 TDP1 (0.35) TDP1ALDH1A1

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
WO-2022131780-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME 솔루스첨단소재 주식회사 2022-06-23 — — WO disclosed
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