SCHEMBL7342064

SCHEMBL7342064

Cc1cccc(Nc2ccccc2CNO)c1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.54
▸ TP53 P04637 1/20 0.54
▸ GAA P10253 1/20 0.54
▸ MAPK1 P28482 1/20 0.54
▸ HSD17B10 Q99714 1/20 0.54
▸ PTGS2 P35354 4/20 0.51
▸ MEN1 O00255 3/20 0.51
▸ KMT2A Q03164 3/20 0.51
▸ LMNA P02545 2/20 0.51
▸ PTGS1 P23219 2/20 0.51
▸ AKR1B10 O60218 1/20 0.51
▸ TRPA1 O75762 1/20 0.51
▸ ABCB11 O95342 1/20 0.51
▸ DHFR P00374 1/20 0.51
▸ MPO P05164 1/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CHRM1 P11229 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ AKR1B1 P15121 1/20 0.51

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
SCHEMBL7341451 0.83 PTGS2 (0.54) MAPTTP53GAAMAPK1HSD17B10
SCHEMBL1922753 0.78 LMNA (0.63) MAPTTP53GAAMAPK1HSD17B10
SCHEMBL7162418 0.78 PTGS2 (0.75) PTGS2MEN1KMT2ALMNAPTGS1
SCHEMBL4189645 0.78 RAPGEF4 (0.65) MAPTGAAHSD17B10PTGS2MEN1
SCHEMBL11403543 0.76 KMT2A (0.61) MAPTTP53GAAMAPK1HSD17B10
SCHEMBL8014820 0.76 CHRM2 (0.53) MAPTGAAPTGS2MEN1KMT2A
SCHEMBL7346692 0.74 PTGS2 (0.52) MAPTTP53GAAMAPK1HSD17B10
SCHEMBL9806533 0.72 MAPT (0.52) MAPTGAAPTGS2MEN1KMT2A
SCHEMBL7347293 0.71 PTGS2 (0.62) GAAMAPK1PTGS2KMT2ALMNA
SCHEMBL7350264 0.71 CLCN2 (0.67) MAPTGAAMAPK1PTGS2MEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5112846-A Nonsteroidal antiinflammatory agents WARNER-LAMBERT COMPANY (US) 1992-05-12 — — US disclosed
US-5075330-A N-hydroxyamide, N-hydroxythioamide, N-hydroxyurea, and N-hydroxythiourea derivatives of selected NSAIDS as antiinflammatory agents WARNER-LAMBERT CO. (US) 1991-12-24 — — US disclosed
US-4981865-A N-hydroxyamide, N-hydroxythioamide, hydroxyurea, and N-hydroxythiourea derivatives of selected nsaids as antiinflammatory agents WARNER-LAMBERT CO. (US) 1991-01-01 — — US disclosed
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