SCHEMBL9979464

SCHEMBL9979464

COC(=O)C1Cc2cccc(O)c2C1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46
ACHE P22303 2/20 0.46
KMT2A Q03164 1/20 0.46
HSD11B1 P28845 2/20 0.42
CHRM3 P20309 2/20 0.42
CA12 O43570 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
DRD2 P14416 4/20 0.41
DRD3 P35462 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM1 P11229 1/20 0.41

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
SCHEMBL1339793 0.84 KMT2A (0.46) CA1CA2ACHEKMT2A
SCHEMBL14392825 0.84 KMT2A (0.46) CA1CA2ACHEKMT2A
SCHEMBL31278113 0.84 KMT2A (0.46) CA1CA2ACHEKMT2A
SCHEMBL7221370 0.83 CA12 (0.46) CA1CA2KMT2AHSD11B1CA12
SCHEMBL20573432 0.83 S1PR5 (0.45) CA1CA2ACHEHSD11B1DRD2
SCHEMBL30967925 0.83 KMT2A (0.44) CA1CA2ACHEKMT2A
SCHEMBL4013407 0.83 KMT2A (0.44) CA1CA2ACHEKMT2A
SCHEMBL2071684 0.83 KMT2A (0.44) KMT2A
SCHEMBL14231689 0.83 KMT2A (0.44) CA1CA2ACHEKMT2ADRD2
SCHEMBL4018322 0.83 KMT2A (0.44) CA1CA2ACHEKMT2ADRD2

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-2012081570-A1 LACTAM COMPOUND OR A SALT THEREOF, AND PPAR ACTIVATOR あすか製薬株式会社 (JP) 2012-06-21 WO disclosed