SCHEMBL30228504

SCHEMBL30228504

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

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.52
▸ KCNA3 P22001 2/20 0.46
▸ MAPT P10636 7/20 0.45
▸ TSHR P16473 2/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ HTT P42858 2/20 0.43
▸ HPGD P15428 3/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ MAP1LC3B Q9GZQ8 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ TP53 P04637 1/20 0.40
▸ GAA P10253 1/20 0.40

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
SCHEMBL30228654 0.84 KCNA3 (0.44) ALDH1A1KCNA3MAPTTSHRALOX15
SCHEMBL30228405 0.82 CA9 (0.56) ALDH1A1KCNA3MAPTTSHRALOX15
SCHEMBL30228286 0.77 KCNA3 (0.47) ALDH1A1KCNA3MAPTTSHRALOX15
SCHEMBL30228422 0.76 KCNA3 (0.46) ALDH1A1KCNA3MAPTTSHRALOX15
SCHEMBL30228381 0.71 KCNA3 (0.56) ALDH1A1KCNA3HPGDMEN1KMT2A
SCHEMBL30231625 0.70 MAP1LC3B (0.74) ALDH1A1MAPTTSHRALOX15MAPK1
Hydrochloric Acid SCHEMBL30228355 0.70 KCNA3 (0.55) ALDH1A1KCNA3HPGDMEN1KMT2A
SCHEMBL30228412 0.70 KCNA3 (0.62) ALDH1A1KCNA3HPGDMEN1KMT2A
SCHEMBL5691199 0.70 KCNA3 (0.62) ALDH1A1KCNA3HPGDMEN1KMT2A
SCHEMBL31711138 0.70 MAPT (0.42) ALDH1A1KCNA3MAPTTSHRALOX15

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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