SCHEMBL9667253

SCHEMBL9667253

CC(O)Cc1ccc(COC(N)=O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 1/20 0.42
▸ LTA4H P09960 2/20 0.41
▸ LAP3 P28838 1/20 0.41
▸ TAAR1 Q96RJ0 3/20 0.40
▸ SLC6A2 P23975 1/20 0.40
▸ ESR1 P03372 1/20 0.39
▸ ESR2 Q92731 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ TPSAB1 Q15661 2/20 0.38
▸ PLG P00747 1/20 0.38
▸ PRSS1 P07477 1/20 0.38
▸ ALOX5 P09917 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CXCR1 P25024 1/20 0.37
▸ CXCR2 P25025 1/20 0.37

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
SCHEMBL13248903 0.87 EPHX1 (0.56) EPHX1ESR1ALOX5CXCR1CXCR2
SCHEMBL30437401 0.82 KMT2A (0.50) SLC6A2ALDH1A1MAPK1L3MBTL1MEN1
SCHEMBL23533687 0.79 F2 (0.43) EPHX1ESR1ESR2ALDH1A1TPSAB1
Benzyl Carbamate SCHEMBL28618318 0.78 ALDH1A1 (0.60) SLC6A2ALDH1A1ALOX5MAPK1L3MBTL1
Benzyl Carbamate SCHEMBL11299634 0.77 ALDH1A1 (0.55) SLC6A2ALDH1A1MAPK1L3MBTL1MEN1
SCHEMBL2297635 0.77 PARP10 (0.54) ALDH1A1MAPK1L3MBTL1CA1CA2
SCHEMBL143772 0.77 MEN1 (0.61) TAAR1SLC6A2ESR1ESR2ALDH1A1
SCHEMBL9667255 0.76 CYP1A2 (0.41) ALDH1A1KMT2A
SCHEMBL196800 0.76 TAAR1 (0.48) TAAR1SLC6A2ESR1ESR2ALOX5
SCHEMBL7282454 0.76 CA2 (0.57) ALDH1A1MAPK1L3MBTL1CA2

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
EP-0463998-A2 Immunological detection of triasulfuron CIBA-GEIGY AG (CH) 1992-01-02 — — EP disclosed
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