SCHEMBL14947001

SCHEMBL14947001

CC(=O)Nc1cccc(N2C(=O)c3ccc(C)cc3C2=O)c1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.81
▸ POLB P06746 3/20 0.71
▸ ALDH1A1 P00352 3/20 0.71
▸ HPGD P15428 1/20 0.71
▸ AHR P35869 1/20 0.56
▸ HSD17B10 Q99714 2/20 0.55
▸ SCN2A Q99250 1/20 0.55
▸ TDP1 Q9NUW8 1/20 0.54
▸ CA9 Q16790 2/20 0.52
▸ CA12 O43570 1/20 0.52
▸ CA1 P00915 1/20 0.52
▸ GAA P10253 1/20 0.48
▸ MAPT P10636 1/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ USP2 O75604 1/20 0.47
▸ BLM P54132 1/20 0.47
▸ CTDSP1 Q9GZU7 1/20 0.47
▸ ESR1 P03372 1/20 0.47
▸ NPC1 O15118 1/20 0.47

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
SCHEMBL17326506 0.84 MAPK1 (0.75) MAPK1POLBALDH1A1HPGDHSD17B10
SCHEMBL2601911 0.81 CA9 (0.59) MAPK1POLBALDH1A1HPGDHSD17B10
SCHEMBL6859165 0.79 MAPK1 (0.58) MAPK1POLBALDH1A1HPGDHSD17B10
SCHEMBL14944810 0.79 POLB (0.67) MAPK1POLBALDH1A1HPGDHSD17B10
SCHEMBL14946985 0.79 MEN1 (0.61) MAPK1POLBALDH1A1HPGDTDP1
SCHEMBL2631561 0.77 ESR1 (0.77) MAPK1POLBALDH1A1HSD17B10CA9
SCHEMBL17326282 0.77 HPGD (0.68) MAPK1POLBALDH1A1HPGDHSD17B10
SCHEMBL676344 0.76 POLB (0.60) MAPK1POLBALDH1A1HPGDHSD17B10
SCHEMBL15033476 0.76 ALDH1A1 (0.62) MAPK1POLBALDH1A1HPGDHSD17B10
SCHEMBL30231754 0.75 CA9 (0.69) MAPK1POLBALDH1A1HPGDHSD17B10

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
US-20130120498-A1 Fluorinated Poly(amide-imide) Copolymer Printhead Coatings XEROX CORPORATION (US) 2013-05-16 — — US disclosed
Send feedback