SCHEMBL301816

SCHEMBL301816

CCCCOC(=O)c1cccc(C)c1C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.64
TDP1 Q9NUW8 3/20 0.64
L3MBTL1 Q9Y468 2/20 0.64
MAPK1 P28482 3/20 0.58
CYP3A4 P08684 3/20 0.58
TP53 P04637 1/20 0.58
ALDH1A1 P00352 6/20 0.57
LMNA P02545 3/20 0.56
HSD17B10 Q99714 2/20 0.56
KDM4E B2RXH2 2/20 0.50
POLB P06746 1/20 0.50
ESR1 P03372 2/20 0.47
CYP1A2 P05177 3/20 0.45
CYP2C19 P33261 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
CYP2D6 P10635 1/20 0.45
NR1H2 P55055 1/20 0.45
RNASEL Q05823 1/20 0.45
ATM Q13315 1/20 0.44
CYP2C9 P11712 1/20 0.44

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
SCHEMBL27908789 0.96 TSHR (0.65) TSHRTDP1L3MBTL1MAPK1CYP3A4
SCHEMBL301815 0.91 TSHR (0.68) TSHRTDP1L3MBTL1MAPK1CYP3A4
SCHEMBL2957176 0.88 TSHR (0.47) TSHRTDP1L3MBTL1MAPK1CYP3A4
SCHEMBL4626793 0.88 TSHR (0.64) TSHRTDP1L3MBTL1MAPK1CYP3A4
SCHEMBL28994388 0.87 TSHR (0.62) TSHRTDP1L3MBTL1MAPK1CYP3A4
SCHEMBL21113658 0.87 TSHR (0.69) TSHRTDP1L3MBTL1MAPK1CYP3A4
SCHEMBL1424504 0.86 TSHR (0.61) TSHRTDP1CYP3A4TP53ALDH1A1
SCHEMBL21113695 0.85 ALDH1A1 (0.69) TSHRTDP1L3MBTL1MAPK1CYP3A4
SCHEMBL27300155 0.85 TSHR (0.68) TSHRTDP1L3MBTL1MAPK1CYP3A4
SCHEMBL11839195 0.84 TSHR (0.61) TSHRTDP1L3MBTL1MAPK1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2070975-B1 POROUS FILM AND SEPARATOR FOR NONAQUEOUS ELECTROLYTE SECONDARY BATTERY SUMITOMO CHEMICAL CO (JP) 2012-01-25 EP disclosed
EP-2067618-B1 MULTILAYER POROUS FILM AND SEPARATOR FOR NONAQUEOUS ELECTROLYTE SECONDARY BATTERY SUMITOMO CHEMICAL CO (JP) 2012-01-11 EP disclosed
US-20100040953-A1 POROUS FILM AND SEPARATOR FOR NONAQUEOUS ELECTROLYTE SECONDARY BATTERY SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-02-18 US disclosed
US-20100015515-A1 LAMINATED POROUS FILM AND SEPARATOR FOR NONAQUEOUS ELECTROLYTE SECONDARY BATTERY SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-01-21 US disclosed
EP-2070975-A1 POROUS FILM AND SEPARATOR FOR NONAQUEOUS ELECTROLYTE SECONDARY BATTERY Sumitomo Chemical Company, Limited (JP) 2009-06-17 EP disclosed
EP-2067618-A1 MULTILAYER POROUS FILM AND SEPARATOR FOR NONAQUEOUS ELECTROLYTE SECONDARY BATTERY Sumitomo Chemical Company, Limited (JP) 2009-06-10 EP disclosed