SCHEMBL30231429

SCHEMBL30231429

Cc1cc(O)cc2oc(=O)cc(-c3ccc(F)cc3)c12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAP1LC3B Q9GZQ8 1/20 0.55
▸ MAPT P10636 6/20 0.54
▸ ALDH1A1 P00352 7/20 0.54
▸ HPGD P15428 3/20 0.54
▸ CA9 Q16790 2/20 0.54
▸ TSHR P16473 2/20 0.54
▸ CYP3A4 P08684 1/20 0.54
▸ CASP1 P29466 1/20 0.54
▸ CASP7 P55210 1/20 0.54
▸ HSD17B10 Q99714 1/20 0.54
▸ CA12 O43570 1/20 0.50
▸ ALOX15 P16050 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ ABCB1 P08183 1/20 0.48
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ GLA P06280 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ GAA P10253 1/20 0.47

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
SCHEMBL30231625 0.86 MAP1LC3B (0.74) MAP1LC3BMAPTALDH1A1HPGDCA9
SCHEMBL29115369 0.86 MAP1LC3B (0.74) MAP1LC3BMAPTALDH1A1HPGDCA9
SCHEMBL30677928 0.86 MAP1LC3B (0.74) MAP1LC3BMAPTALDH1A1HPGDCA9
SCHEMBL30228362 0.81 ALDH1A1 (0.75) MAP1LC3BMAPTALDH1A1HPGDCA9
SCHEMBL30228405 0.77 CA9 (0.56) MAP1LC3BMAPTALDH1A1HPGDCA9
SCHEMBL11215292 0.77 ALDH1A1 (0.79) MAP1LC3BMAPTALDH1A1HPGDCA9
SCHEMBL30231670 0.76 ALDH1A1 (0.57) MAPTALDH1A1HPGDHSD17B10KMT2A
SCHEMBL30231669 0.76 ALDH1A1 (0.57) MAPTALDH1A1HPGDHSD17B10KMT2A
SCHEMBL21648244 0.75 CA12 (0.74) ALDH1A1HPGDCA9CASP1CASP7
SCHEMBL8580581 0.75 MAP1LC3B (0.80) MAP1LC3BMAPTALDH1A1HPGDCA9

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
WO-2023034339-A1 HYDROXY AND ALKOXY COUMARINS AS MODULATORS OF POLRMT PRETZEL THERAPEUTICS, INC. (US) 2023-03-09 — — WO disclosed
WO-2023034340-A1 HYDROXY AND ALKOXY COUMARINS AS MODULATORS OF POLRMT PRETZEL THERAPEUTICS, INC. (US) 2023-03-09 — — WO disclosed
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