SCHEMBL30228362

SCHEMBL30228362

Cc1cc(O)c2c(-c3ccc(F)cc3)cc(=O)oc2c1

nearest known ligand 0.75

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.75
▸ MAPK1 P28482 2/20 0.75
▸ ALOX15 P16050 1/20 0.75
▸ TSHR P16473 1/20 0.75
▸ MAP1LC3B Q9GZQ8 1/20 0.55
▸ MAPT P10636 7/20 0.54
▸ HTT P42858 3/20 0.54
▸ HPGD P15428 2/20 0.54
▸ GAA P10253 1/20 0.54
▸ PPARG P37231 1/20 0.54
▸ MAPK10 P53779 1/20 0.54
▸ NCOA2 Q15596 1/20 0.54
▸ RXFP1 Q9HBX9 1/20 0.54
▸ KDM4C Q9H3R0 1/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ CA12 O43570 1/20 0.47
▸ CA9 Q16790 1/20 0.47
▸ ADORA3 P0DMS8 1/20 0.45

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
SCHEMBL30677928 0.86 MAP1LC3B (0.74) ALDH1A1MAPK1ALOX15TSHRMAP1LC3B
SCHEMBL29115369 0.86 MAP1LC3B (0.74) ALDH1A1MAPK1ALOX15TSHRMAP1LC3B
SCHEMBL30231429 0.81 MAP1LC3B (0.55) ALDH1A1MAPK1ALOX15TSHRMAP1LC3B
SCHEMBL30227915 0.76 ALDH1A1 (0.64) ALDH1A1MAPK1ALOX15TSHRMAPT
SCHEMBL4077549 0.75 CA12 (0.65) ALDH1A1MAPTHPGDCA12CA9
SCHEMBL8580581 0.75 MAP1LC3B (0.80) ALDH1A1MAPK1ALOX15TSHRMAP1LC3B
SCHEMBL30228241 0.74 ALDH1A1 (0.57) ALDH1A1MAPK1ALOX15TSHRMAPT
SCHEMBL30228252 0.74 ALDH1A1 (0.57) ALDH1A1MAPK1ALOX15TSHRMAPT
SCHEMBL12457526 0.74 ALDH1A1 (0.74) ALDH1A1MAPK1ALOX15TSHRMAPT
SCHEMBL11789592 0.71 ALDH1A1 (0.46) ALDH1A1MAPK1ALOX15TSHRMAP1LC3B

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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