SCHEMBL10587274

SCHEMBL10587274

CC(C)c1ccc(CCOO)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.43
PPARG P37231 1/20 0.42
PPARD Q03181 1/20 0.42
PPARA Q07869 1/20 0.42
ALDH1A1 P00352 3/20 0.41
FKBP1A P62942 1/20 0.41
MAPT P10636 2/20 0.40
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
RAB9A P51151 4/20 0.39
LMNA P02545 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
S1PR1 P21453 1/20 0.38
S1PR3 Q99500 1/20 0.38
NPC1 O15118 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
KDM4E B2RXH2 2/20 0.37
EPHX1 P07099 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
SCHEMBL2362990 0.83 IDO1 (0.52) IDO1L3MBTL1PPARGPPARDPPARA
SCHEMBL17660203 0.81 L3MBTL1 (0.58) IDO1L3MBTL1PPARGPPARDPPARA
SCHEMBL10729588 0.79 IDO1 (0.56) IDO1L3MBTL1ALDH1A1FKBP1ARAB9A
SCHEMBL13416645 0.79 IDO1 (0.44) IDO1L3MBTL1PPARGPPARDPPARA
SCHEMBL29254165 0.78 SMN1; SMN2 (0.45) IDO1L3MBTL1ALDH1A1RAB9ALMNA
SCHEMBL11354558 0.78 IDO1 (0.63) IDO1L3MBTL1ALDH1A1RXRARXRB
SCHEMBL10053298 0.77 L3MBTL1 (0.44) IDO1L3MBTL1PPARGPPARDPPARA
SCHEMBL15396308 0.76 CYP1A2 (0.50) IDO1L3MBTL1MAPT
SCHEMBL28454343 0.76 TAAR1 (0.50) IDO1L3MBTL1ALDH1A1MAPTLMNA
SCHEMBL28544358 0.76 TAAR1 (0.50) IDO1

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-0332386-A2 Cyclic monoperoxyketal NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-09-13 EP disclosed