SCHEMBL29306830

SCHEMBL29306830

c1ccc2c(-c3c4ccccc4c(-c4ccc5cc(-c6ccc7cc(-c8c9ccccc9c(-c9cccc%10oc%11ccccc%11c9%10)c9ccccc89)ccc7c6)ccc5c4)c4ccccc34)cccc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ ALDH1A1 P00352 4/20 0.36
▸ HSD17B10 Q99714 3/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ PIM1 P11309 2/20 0.36
▸ MAPT P10636 3/20 0.35
▸ HPGD P15428 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ ALOX5 P09917 1/20 0.35
▸ CA12 O43570 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ CYP1A1 P04798 1/20 0.35
▸ CYP1B1 Q16678 1/20 0.35

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
SCHEMBL26949747 0.96 TDP1 (0.38) TDP1L3MBTL1ALDH1A1HSD17B10KDM4E
SCHEMBL26949404 0.95 TDP1 (0.38) TDP1L3MBTL1ALDH1A1PIM1MAPT
SCHEMBL26950238 0.95 TDP1 (0.38) TDP1L3MBTL1ALDH1A1CYP1A2CYP2C19
SCHEMBL22063384 0.95 TDP1 (0.39) TDP1L3MBTL1ALDH1A1HSD17B10KDM4E
SCHEMBL26949955 0.94 TDP1 (0.37) TDP1L3MBTL1ALDH1A1HSD17B10KDM4E
SCHEMBL26949831 0.94 TDP1 (0.37) TDP1L3MBTL1ALDH1A1HSD17B10KDM4E
SCHEMBL26949748 0.93 HSD17B1 (0.37) TDP1L3MBTL1ALDH1A1PIM1MAPT
SCHEMBL18382852 0.93 L3MBTL1 (0.39) TDP1L3MBTL1ALDH1A1HSD17B10CYP1A2
SCHEMBL17945180 0.92 CASP3 (0.38) TDP1L3MBTL1ALDH1A1HSD17B10KDM4E
SCHEMBL24285489 0.92 TDP1 (0.39) TDP1L3MBTL1ALDH1A1PIM1MAPT

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
US-20240237384-A1 ORGANIC ELECTROLUMINESCENT DEVICE SFC CO., LTD. (KR) 2024-07-11 — — US disclosed
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