SCHEMBL31574430

SCHEMBL31574430

Cc1cc(C(=O)OC2CC(OC(=O)c3ccc(O)c(C)c3)CC(OC(=O)c3ccc(O)c(C)c3)C2)ccc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
CYP2D6 P10635 4/20 0.52
SERPINE1 P05121 2/20 0.47
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44
CA14 Q9ULX7 2/20 0.44
CYP2C19 P33261 2/20 0.43
HTR3E A5X5Y0 2/20 0.43
HTR3B O95264 2/20 0.43
HTR3A P46098 2/20 0.43
HTR3D Q70Z44 2/20 0.43
HTR3C Q8WXA8 2/20 0.43
XDH P47989 1/20 0.43
CYP1A2 P05177 1/20 0.43
NR1I2 O75469 1/20 0.43
SCN1A P35498 1/20 0.42

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
SCHEMBL31574438 0.94 KMT2A (0.49) KMT2AMEN1CYP2D6SERPINE1CA12
SCHEMBL31574431 0.94 KMT2A (0.49) KMT2AMEN1CYP2D6SERPINE1CA12
SCHEMBL17941264 0.86 STS (0.52) KMT2AMEN1CYP2D6SERPINE1SCN1A
SCHEMBL17941233 0.82 SERPINE1 (0.45) KMT2AMEN1CYP2D6SERPINE1CA12
SCHEMBL9895339 0.79 SERPINE1 (0.46) KMT2AMEN1CYP2D6SERPINE1CA12
SCHEMBL17460977 0.79 SERPINE1 (0.46) KMT2AMEN1CYP2D6SERPINE1CA12
SCHEMBL9923602 0.79 SERPINE1 (0.46) KMT2AMEN1CYP2D6SERPINE1CA12
SCHEMBL9895337 0.78 TAS1R3 (0.46) KMT2AMEN1CYP2D6SERPINE1CA12
SCHEMBL172476 0.77 CA1 (0.71) KMT2AMEN1CA12CA1CA2
SCHEMBL25840025 0.76 SERPINE1 (0.51) KMT2AMEN1CYP2D6SERPINE1SCN1A

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
CN-120019086-A Vinyl compound, vinyl composition, cured vinyl resin, prepreg, resin-coated film, resin-coated metal foil, metal-clad laminate, and printed wiring board 住友化学株式会社 2025-05-16 CN disclosed