SCHEMBL15315477

SCHEMBL15315477

CC(C)c1cccc(C(=O)c2ccc(C(C)C)c(C(C)C)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 5/20 0.53
PTGS2 P35354 5/20 0.53
MAPT P10636 5/20 0.53
ALDH1A1 P00352 4/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
CYP3A4 P08684 3/20 0.53
CXCR1 P25024 2/20 0.53
CXCR2 P25025 2/20 0.53
KDM4E B2RXH2 2/20 0.53
HPGD P15428 2/20 0.53
LMNA P02545 2/20 0.53
RECQL P46063 1/20 0.53
MAPK1 P28482 1/20 0.53
PMP22 Q01453 1/20 0.53
SLC22A6 Q4U2R8 1/20 0.53
HSD17B10 Q99714 1/20 0.53
CXCL8 P10145 1/20 0.53
THPO P40225 1/20 0.53
HIF1A Q16665 1/20 0.53
GABRA1 P14867 1/20 0.50

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
SCHEMBL11756980 0.88 MAPT (0.65) PTGS1PTGS2MAPTALDH1A1SMN1; SMN2
SCHEMBL15315482 0.86 GABRA1 (0.53) PTGS1PTGS2ALDH1A1SMN1; SMN2CYP3A4
SCHEMBL12648769 0.84 GABRA1 (0.69) PTGS1PTGS2MAPTALDH1A1SMN1; SMN2
SCHEMBL764365 0.82 MAPT (0.74) PTGS1PTGS2MAPTALDH1A1SMN1; SMN2
SCHEMBL24600462 0.81 MAPT (0.59) PTGS1PTGS2MAPTALDH1A1SMN1; SMN2
SCHEMBL9320213 0.79 MAPT (0.56) PTGS1PTGS2MAPTALDH1A1SMN1; SMN2
SCHEMBL2623891 0.77 KDM4E (0.50) PTGS1PTGS2MAPTALDH1A1SMN1; SMN2
SCHEMBL10942319 0.76 MAPT (0.53) PTGS1PTGS2MAPTALDH1A1SMN1; SMN2
SCHEMBL27608004 0.75 RXRA (0.53) PTGS1PTGS2MAPTALDH1A1SMN1; SMN2
SCHEMBL30444032 0.74 RXRA (0.66) PTGS1PTGS2MAPTALDH1A1SMN1; SMN2

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
US-9065138-B2 Water soluble binder composition, method of producing the same and electrode for rechargeable battery employing the same SAMSUNG SDI CO., LTD. (KR) 2015-06-23 US disclosed
US-20130273423-A1 WATER SOLUBLE BINDER COMPOSITION, METHOD OF PRODUCING THE SAME AND ELECTRODE FOR RECHARGEABLE BATTERY EMPLOYING THE SAME SAMSUNG SDI CO., LTD. (KR) 2013-10-17 US disclosed