SCHEMBL9318384

SCHEMBL9318384

Cc1ccc(-c2cnccc2OC(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 14/20 0.51
RPS6KA3 P51812 2/20 0.44
KMT2A Q03164 1/20 0.40
CYP46A1 Q9Y6A2 1/20 0.39
BTK Q06187 1/20 0.37
DHODH Q02127 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
SCHEMBL12864158 0.78 NAAA (0.47) SLC22A12RPS6KA3
SCHEMBL6447567 0.77 LMNA (0.55)
SCHEMBL27556162 0.77 PTGDR2 (0.54)
SCHEMBL485961 0.76 TDP1 (0.43) KMT2A
SCHEMBL9318380 0.76 SLC22A12 (0.55) SLC22A12RPS6KA3KMT2ACYP46A1DHODH
SCHEMBL377258 0.74 ALDH1A1 (0.39) KMT2A
SCHEMBL9413729 0.73 TDP1 (0.47) KMT2A
SCHEMBL28042716 0.72 BACE1 (0.39) SLC22A12KMT2A
SCHEMBL11442668 0.72 PTGDR2 (0.49) KMT2ADHODH
SCHEMBL29788267 0.72 GSK3B (0.55) SLC22A12

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
EP-0300461-B1 Aromatic heterocyclic peroxyacids AUSIMONT SPA (IT) 1994-01-12 EP claimed