SCHEMBL30227989

SCHEMBL30227989

[2H]c1c(-c2ccccc2C)c2ccc(O)cc2oc1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.59
▸ ALDH1A1 P00352 5/20 0.59
▸ HPGD P15428 4/20 0.59
▸ HSD17B10 Q99714 4/20 0.59
▸ GAA P10253 2/20 0.59
▸ TP53 P04637 1/20 0.59
▸ USP2 O75604 1/20 0.58
▸ CA12 O43570 8/20 0.56
▸ CA9 Q16790 8/20 0.56
▸ HSD17B3 P37058 5/20 0.56
▸ AKR1B1 P15121 2/20 0.56
▸ MAOB P27338 2/20 0.56
▸ LMNA P02545 1/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ GLA P06280 1/20 0.56
▸ CYP2C9 P11712 1/20 0.56
▸ UGT1A1 P22309 1/20 0.56
▸ CASP1 P29466 1/20 0.56
▸ KDR P35968 1/20 0.56
▸ CASP7 P55210 1/20 0.56

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
SCHEMBL30228248 0.87 CA12 (0.70) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL22431749 0.87 CA12 (0.70) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL30228211 0.76 CA12 (0.67) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL29036860 0.73 KDM4E (1.00) KDM4EALDH1A1HPGDHSD17B10GAA
Hymecromone SCHEMBL29624431 0.73 HSD17B3 (1.00) KDM4EALDH1A1HPGDHSD17B10GAA
Hymecromone SCHEMBL29364837 0.73 HSD17B3 (1.00) KDM4EALDH1A1HPGDHSD17B10GAA
Hymecromone SCHEMBL2357040 0.73 HSD17B3 (1.00) KDM4EALDH1A1HPGDHSD17B10GAA
Hymecromone SCHEMBL24150 0.73 HSD17B3 (1.00) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL28585333 0.73 CA12 (0.74) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL14424515 0.72 CA12 (0.75) KDM4EALDH1A1HPGDHSD17B10GAA

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-2023034346-A1 CHROMEN-2-ONE MODULATORS OF POLRMT PRETZEL THERAPEUTICS, INC. (US) 2023-03-09 — — WO disclosed
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