SCHEMBL30228286

SCHEMBL30228286

Cc1ccccc1-c1cc(=O)oc2cc(C=O)cc(C)c12

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KCNA3 P22001 2/20 0.47
▸ MAPT P10636 7/20 0.43
▸ ALDH1A1 P00352 10/20 0.41
▸ HPGD P15428 2/20 0.41
▸ TSHR P16473 2/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ MAOA P21397 1/20 0.38
▸ ATM Q13315 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CASP1 P29466 1/20 0.37
▸ CASP7 P55210 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37

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
SCHEMBL30228422 0.88 KCNA3 (0.46) KCNA3MAPTALDH1A1HPGDTSHR
SCHEMBL30228119 0.81 KCNA3 (0.56) KCNA3ALDH1A1HPGDKDM4EMAOA
SCHEMBL30228405 0.80 CA9 (0.56) KCNA3MAPTALDH1A1HPGDTSHR
SCHEMBL30228504 0.77 ALDH1A1 (0.52) KCNA3MAPTALDH1A1HPGDTSHR
SCHEMBL30228654 0.75 KCNA3 (0.44) KCNA3MAPTALDH1A1HPGDTSHR
SCHEMBL30228352 0.71 KCNA3 (0.55) KCNA3ALDH1A1HPGDKDM4EMAOA
SCHEMBL30228412 0.71 KCNA3 (0.62) KCNA3ALDH1A1HPGDKDM4EMAOA
SCHEMBL5691199 0.71 KCNA3 (0.62) KCNA3ALDH1A1HPGDKDM4EMAOA
SCHEMBL31711138 0.71 MAPT (0.42) KCNA3MAPTALDH1A1HPGDTSHR
SCHEMBL13908157 0.69 ALDH1A1 (0.53) ALDH1A1HPGDTSHRMAPK1KDM4E

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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