SCHEMBL31574443

SCHEMBL31574443

Cc1cc(C(=O)C2CC(C(=O)c3ccc(O)c(C)c3)CC(C(=O)c3ccc(O)c(C)c3)C2)ccc1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.42
TP53 P04637 1/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
CYP2D6 P10635 1/20 0.41
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
DYRK1A Q13627 1/20 0.40
DYRK1B Q9Y463 1/20 0.40
KDM2B Q8NHM5 1/20 0.40
HSD17B1 P14061 4/20 0.40
HSD17B2 P37059 4/20 0.40
PDE10A Q9Y233 1/20 0.39
ESR1 P03372 2/20 0.38
ESR2 Q92731 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
RAB9A P51151 2/20 0.38
HTT P42858 1/20 0.38
SLC22A6 Q4U2R8 1/20 0.38
SLC22A8 Q8TCC7 1/20 0.38

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
SCHEMBL31574439 0.93 HTT (0.45) TDP1TP53KMT2AMEN1CYP2D6
SCHEMBL31574442 0.93 HTT (0.45) TDP1TP53KMT2AMEN1CYP2D6
SCHEMBL15851142 0.89 MEN1 (0.49) TDP1TP53KMT2AMEN1CYP2D6
SCHEMBL15851060 0.84 SRD5A2 (0.50) KMT2AMEN1CYP2D6TAS1R3TAS1R1
SCHEMBL31590951 0.76 TDP1 (0.48) TDP1TP53KMT2ADYRK1ADYRK1B
SCHEMBL1758239 0.76 HTT (0.61) TDP1TP53DYRK1ADYRK1BHSD17B1
SCHEMBL31621156 0.76 HTT (0.61) TDP1TP53DYRK1ADYRK1BHSD17B1
SCHEMBL11053174 0.74 HTT (0.64) TDP1TP53DYRK1ADYRK1BHSD17B1
SCHEMBL172420 0.74 CA12 (0.64) TDP1TP53KMT2AMEN1CYP2D6
SCHEMBL172723 0.74 PKM (0.57) TDP1TP53DYRK1ADYRK1BHSD17B1

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