SCHEMBL22738713

SCHEMBL22738713

COc1ccc2cc(/C(=N/O)C(F)(F)F)c(=O)oc2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.62
▸ HPGD P15428 5/20 0.62
▸ GAA P10253 3/20 0.62
▸ MAOB P27338 3/20 0.62
▸ SLC16A3 O15427 1/20 0.62
▸ KDM4E B2RXH2 6/20 0.58
▸ GLA P06280 3/20 0.58
▸ HSD17B10 Q99714 2/20 0.58
▸ RAB9A P51151 2/20 0.56
▸ NPC1 O15118 2/20 0.56
▸ CA12 O43570 2/20 0.56
▸ CA2 P00918 2/20 0.56
▸ CA3 P07451 2/20 0.56
▸ CA6 P23280 2/20 0.56
▸ CA7 P43166 2/20 0.56
▸ CA9 Q16790 2/20 0.56
▸ CA14 Q9ULX7 2/20 0.56
▸ POLB P06746 1/20 0.56
▸ CA4 P22748 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56

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
SCHEMBL17999229 1.00 ALDH1A1 (0.62) ALDH1A1HPGDGAAMAOBSLC16A3
SCHEMBL23154030 0.85 ALDH1A1 (0.56) ALDH1A1HPGDGAAMAOBSLC16A3
SCHEMBL29029753 0.84 HSD11B1 (0.59) ALDH1A1HPGDGAAMAOBSLC16A3
SCHEMBL23153872 0.84 ALDH1A1 (0.55) ALDH1A1HPGDGAAMAOBSLC16A3
SCHEMBL23154380 0.84 ALDH1A1 (0.55) ALDH1A1HPGDGAAMAOBSLC16A3
SCHEMBL17999239 0.84 HSD11B1 (0.59) ALDH1A1HPGDGAAMAOBSLC16A3
SCHEMBL17999117 0.84 ALDH1A1 (0.55) ALDH1A1HPGDGAAMAOBSLC16A3
SCHEMBL17999230 0.83 ALDH1A1 (0.71) ALDH1A1HPGDGAAMAOBSLC16A3
SCHEMBL23154376 0.82 ALDH1A1 (0.65) ALDH1A1HPGDGAAMAOBSLC16A3
SCHEMBL22001514 0.82 ALDH1A1 (0.72) ALDH1A1HPGDGAAMAOBSLC16A3

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-2020241529-A1 CARBAMOYL OXIME COMPOUND, AND POLYMERIZATION INITIATOR AND POLYMERIZABLE COMPOSITION CONTAINING SAID COMPOUND 株式会社ADEKA 2020-12-03 — — WO disclosed
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