SCHEMBL2362990

SCHEMBL2362990

CC(C)c1ccc(CCOCCc2ccc(C(C)C)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.52
L3MBTL1 Q9Y468 2/20 0.46
PPARG P37231 1/20 0.40
PPARD Q03181 1/20 0.40
PPARA Q07869 1/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.40
FKBP1A P62942 1/20 0.39
PYCR1 P32322 1/20 0.39
MAPT P10636 1/20 0.39
KCNH2 Q12809 1/20 0.39
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
RAB9A P51151 1/20 0.38
DHFR P00374 1/20 0.37
MAOB P27338 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM1 P11229 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
SCHEMBL17660203 0.84 L3MBTL1 (0.58) IDO1L3MBTL1PPARGPPARDPPARA
SCHEMBL10729588 0.83 IDO1 (0.56) IDO1L3MBTL1MEN1LMNAKMT2A
SCHEMBL10587274 0.83 IDO1 (0.48) IDO1L3MBTL1PPARGPPARDPPARA
SCHEMBL23422323 0.82 ADRB1 (0.52) IDO1L3MBTL1MEN1LMNAKMT2A
SCHEMBL18195304 0.79 L3MBTL1 (0.49) IDO1L3MBTL1MEN1LMNAKMT2A
SCHEMBL10613207 0.78 IDO1 (0.44) IDO1L3MBTL1PPARGPPARDPPARA
SCHEMBL13416645 0.78 IDO1 (0.44) IDO1L3MBTL1PPARGPPARDPPARA
SCHEMBL4535971 0.77 PTGS2 (0.42) LMNA
SCHEMBL24211735 0.77 L3MBTL1 (0.54) IDO1L3MBTL1MEN1LMNAKMT2A
Hydrogen Peroxide SCHEMBL9342704 0.77 CYP4A11 (0.41) IDO1L3MBTL1PPARAMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2534281-B1 METHOD FOR PRODUCING 4-ISOPROPYLCYCLOHEXYLMETHANOL BASF SE (DE) 2019-01-09 EP disclosed
EP-2534281-A2 METHOD FOR PRODUCING 4-ISOPROPYLCYCLOHEXYLMETHANOL BASF SE (DE) 2012-12-19 EP disclosed
WO-2011098432-A2 METHOD FOR PRODUCING 4-ISOPROPYLCYCLOHEXYLMETHANOL BASF SE (DE) 2011-08-18 WO disclosed
WO-2009059941-A1 METHOD FOR TEH REGIOSELECTIVE ALKOXYALKYLATION OF SUBSTITUTED BENZENES BASF SE (DE) 2009-05-14 WO disclosed
WO-2009059944-A1 ELECTROCHEMICAL METHOD FOR PRODUCING BENZALDEHYDE DIMETHYL ACETYLENE BASF SE (DE) 2009-05-14 WO disclosed
EP-0554564-A1 Process for preparing benzaldehyde acetals BASF Aktiengesellschaft (DE) 1993-08-11 EP disclosed
EP-0054698-A1 4,4'-Diphenyl ether-dialdehyde-bis-dimethyl acetal, and a method for its preparation HOECHST AKTIENGESELLSCHAFT (DE) 1982-06-30 EP disclosed