SCHEMBL8749134

SCHEMBL8749134

Cc1ccc(CCC(=O)C(Cc2ccc(C)cc2)=[N+]=[N-])cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
FFAR1 O14842 4/20 0.47
PLAAT3 P53816 2/20 0.46
PLAAT5 Q96KN8 2/20 0.46
PLAAT2 Q9NWW9 2/20 0.46
PLAAT4 Q9UL19 2/20 0.46
SLC5A1 P13866 1/20 0.42
SLC5A2 P31639 1/20 0.42
ALDH1A1 P00352 1/20 0.40
CTBP2 P56545 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HPGD P15428 3/20 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
SCHEMBL8749208 0.83 KEAP1 (0.50) L3MBTL1TDP1FFAR1PLAAT3PLAAT5
SCHEMBL8749091 0.83 F2RL1 (0.54) FFAR1PLAAT3PLAAT5PLAAT2PLAAT4
SCHEMBL8748624 0.81 PLAAT3 (0.49) L3MBTL1TDP1FFAR1PLAAT3PLAAT5
SCHEMBL8748635 0.80 CTBP2 (0.43) L3MBTL1TDP1FFAR1ALDH1A1CTBP2
SCHEMBL1681600 0.73 PLAAT3 (0.54) L3MBTL1TDP1FFAR1PLAAT3PLAAT5
SCHEMBL7338189 0.70 TDP1 (0.69) L3MBTL1TDP1FFAR1PLAAT3PLAAT5
SCHEMBL9547922 0.70 CES2 (0.56) L3MBTL1TDP1FFAR1PLAAT3PLAAT5
SCHEMBL8749106 0.69 ALDH1A1 (0.46) L3MBTL1TDP1FFAR1PLAAT3PLAAT5
SCHEMBL363773 0.69 ALDH1A1 (0.65) L3MBTL1TDP1FFAR1PLAAT3PLAAT5
SCHEMBL6393031 0.69 FFAR1 (0.56) L3MBTL1TDP1FFAR1PLAAT3PLAAT5

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-5627006-A ALKENYLOXY-SUBSTITUTED POLYVINYLPHENOLS, PHOTOSENSITIVE ACID GENERATOR WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1997-05-06 US disclosed
EP-0552548-B1 Resist material WAKO PURE CHEM IND LTD (JP) 1997-03-19 EP disclosed
EP-0552548-A1 Resist material WAKO PURE CHEMICAL INDUSTRIES LTD (JP) 1993-07-28 EP disclosed