SCHEMBL31329366

SCHEMBL31329366

c1ccc2cc(CC3CO3)c(CC3CO3)cc2c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.44
ALDH1A1 P00352 3/20 0.42
TSHR P16473 3/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HIF1A Q16665 1/20 0.42
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GLA P06280 1/20 0.36
KDM4E B2RXH2 2/20 0.35
ATM Q13315 1/20 0.35
DHFR P00374 1/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
MAPT P10636 1/20 0.33

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
SCHEMBL6480647 0.81 TDP1 (0.45) TDP1ALDH1A1TSHRTP53CYP3A4
SCHEMBL29826970 0.81 TDP1 (0.45) TDP1ALDH1A1TSHRTP53CYP3A4
SCHEMBL1673437 0.80 HTR2A (0.39) TDP1ALDH1A1TSHRTP53CYP3A4
Methane SCHEMBL27917831 0.79 TDP1 (0.43) TDP1ALDH1A1TSHRTP53CYP3A4
Ammonia Solution, Strong SCHEMBL27798784 0.79 TDP1 (0.43) TDP1ALDH1A1TSHRTP53CYP3A4
SCHEMBL4257315 0.79 TDP1 (0.32) TDP1ALDH1A1TSHRTP53CYP3A4
SCHEMBL7199928 0.79 KDM4E (0.38) TDP1ALDH1A1TSHRTP53CYP3A4
SCHEMBL845626 0.78 CYP2D6 (0.56) TDP1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL31454831 0.78 CYP1A2 (0.48) TDP1ALDH1A1POLBL3MBTL1KMT2A
SCHEMBL845625 0.78 CYP1A2 (0.48) TDP1ALDH1A1POLBL3MBTL1KMT2A

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
CN-119620539-A Resin composition, photosensitive film with support, printed wiring board, and semiconductor device 味之素株式会社 2025-03-14 CN disclosed
CN-110955115-B Resin composition, photosensitive film with support, printed wiring board, and semiconductor device 味之素株式会社 2025-01-07 CN disclosed