SCHEMBL31602199

SCHEMBL31602199

C=C(C)C(=O)OCc1ccccc1.C=C(C)C(=O)Oc1cccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.47
KMT2A Q03164 3/20 0.47
ALDH1A1 P00352 6/20 0.47
GAA P10253 2/20 0.47
PGR P06401 1/20 0.47
PTGS1 P23219 1/20 0.47
MAPK1 P28482 1/20 0.47
MRGPRX4 Q96LA9 1/20 0.46
KDM4E B2RXH2 3/20 0.44
HPGD P15428 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
MEN1 O00255 2/20 0.43
RAB9A P51151 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MAPT P10636 1/20 0.42
CASP1 P29466 1/20 0.42
FABP3 P05413 5/20 0.40
FABP7 O15540 4/20 0.40
FABP5 Q01469 3/20 0.40
POLB P06746 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
SCHEMBL67480 0.86 ALDH1A1 (0.60) HSD17B10KMT2AALDH1A1GAAPGR
SCHEMBL29373404 0.86 ALDH1A1 (0.60) HSD17B10KMT2AALDH1A1GAAPGR
Methacrylic Acid SCHEMBL3165127 0.84 ALDH1A1 (0.55) HSD17B10KMT2AALDH1A1GAAPGR
SCHEMBL13234388 0.83 ALDH1A1 (0.66) KMT2AALDH1A1MAPK1HPGDTDP1
SCHEMBL13234390 0.83 ALDH1A1 (0.66) KMT2AALDH1A1MAPK1HPGDTDP1
SCHEMBL13234404 0.83 ALDH1A1 (0.66) KMT2AALDH1A1MAPK1HPGDTDP1
SCHEMBL13234396 0.83 ALDH1A1 (0.66) KMT2AALDH1A1MAPK1HPGDTDP1
SCHEMBL13234425 0.83 ALDH1A1 (0.66) KMT2AALDH1A1MAPK1HPGDTDP1
SCHEMBL13234392 0.83 ALDH1A1 (0.66) KMT2AALDH1A1MAPK1HPGDTDP1
SCHEMBL13234389 0.83 ALDH1A1 (0.66) KMT2AALDH1A1MAPK1HPGDTDP1

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-114502605-B Organic microparticles 大金工业株式会社 2025-05-30 CN disclosed