SCHEMBL370080

SCHEMBL370080

Cc1ccc(CCC(=O)c2ccc[nH]c2=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.47
SLC5A1 P13866 1/20 0.46
SLC5A2 P31639 1/20 0.46
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
CYP19A1 P11511 1/20 0.44
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 1/20 0.43
DAO P14920 1/20 0.42
FFAR1 O14842 2/20 0.41
PLAAT3 P53816 1/20 0.40
PLAAT5 Q96KN8 1/20 0.40
PLAAT2 Q9NWW9 1/20 0.40
PLAAT4 Q9UL19 1/20 0.40
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
IGF1R P08069 1/20 0.39

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
SCHEMBL12505702 0.78 NAPRT (0.46) NAPRTNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL12505695 0.77 SLC5A1 (0.52) SLC5A1SLC5A2L3MBTL1TDP1CYP19A1
SCHEMBL3403133 0.74 NAPRT (0.60) NAPRTNPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL30995645 0.73 NAPRT (0.50) NAPRTNPC1RAB9AALDH1A1FFAR1
SCHEMBL12505692 0.72 SLC5A1 (0.44) SLC5A1SLC5A2L3MBTL1TDP1CYP19A1
SCHEMBL2230843 0.71 NAPRT (0.60) NAPRTNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL4940823 0.70 KMT2A (0.62) SLC5A1SLC5A2NPC1RAB9AL3MBTL1
SCHEMBL9121060 0.69 L3MBTL1 (0.62) SLC5A1SLC5A2NPC1RAB9AL3MBTL1
SCHEMBL28022706 0.69 TDP1 (0.53) NPC1RAB9AL3MBTL1TDP1CYP19A1
SCHEMBL3182033 0.68 NAPRT (0.67) NAPRTNPC1RAB9AL3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2593426-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F.HOFFMANN-LA ROCHE AG (CH) 2013-05-22 EP disclosed
WO-2012007365-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F. HOFFMANN-LA ROCHE AG (CH) 2012-01-19 WO disclosed