SCHEMBL31376353

SCHEMBL31376353

CC(Oc1cccc2ccccc12)C(N)=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
HSD17B10 Q99714 2/20 0.49
PGR P06401 1/20 0.49
GAA P10253 1/20 0.49
PTGS1 P23219 1/20 0.49
MAPK1 P28482 1/20 0.49
PPARG P37231 4/20 0.48
PPARA Q07869 4/20 0.48
KDM4E B2RXH2 3/20 0.47
KMT2A Q03164 3/20 0.47
HPGD P15428 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
OGG1 O15527 1/20 0.45
CARM1 Q86X55 1/20 0.44
PRMT6 Q96LA8 1/20 0.44
F9 P00740 1/20 0.44
PLAU P00749 1/20 0.44
MEN1 O00255 2/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL5941038 1.00 ALDH1A1 (0.49) ALDH1A1HSD17B10PGRGAAPTGS1
Benzene SCHEMBL27947280 0.98 PPARG (0.50) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL16933412 0.85 PPARG (0.64) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL2922977 0.85 PPARG (0.64) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL31376342 0.85 PPARG (0.64) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL16933413 0.85 PPARG (0.64) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL11865035 0.83 ALDH1A1 (0.64) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL11807725 0.81 NCEH1 (0.54) PPARGPPARAKMT2AHPGDTDP1
Naprodoxime SCHEMBL11806329 0.81 POLB (0.45) ALDH1A1HSD17B10MAPK1PPARGPPARA
SCHEMBL9721941 0.81 NCEH1 (0.47) ALDH1A1HSD17B10PGRGAAPTGS1

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-119504473-A Method for preparing dichlormid by using sulfur hexafluoride 国网安徽省电力有限公司电力科学研究院 2025-02-25 CN disclosed