SCHEMBL967678

SCHEMBL967678

CCCOC(=O)C(CS)[Zn]C(CS)C(=O)OCCC

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.35
ALDH1A1 P00352 3/20 0.34
LMNA P02545 1/20 0.33
ESR1 P03372 1/20 0.32
CHRM1 P11229 1/20 0.32
TSHR P16473 1/20 0.32
SLC6A2 P23975 1/20 0.32
KDR P35968 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL965961 0.88 ALDH1A1 (0.47) HCAR2ALDH1A1LMNAESR1TSHR
SCHEMBL969199 0.85 NAAA (0.48) HCAR2ALDH1A1LMNATSHR
SCHEMBL966898 0.85 NAAA (0.48) HCAR2ALDH1A1LMNATSHR
SCHEMBL967034 0.85 NAAA (0.48) HCAR2ALDH1A1LMNATSHR
SCHEMBL967184 0.85 NAAA (0.48) HCAR2ALDH1A1LMNATSHR
SCHEMBL963761 0.83 CPB2 (0.42) HCAR2ALDH1A1LMNA
SCHEMBL963005 0.76 TSHR (0.39) TSHR
SCHEMBL6735473 0.74 HCAR2 (0.38) HCAR2ALDH1A1LMNAESR1CHRM1
SCHEMBL964588 0.74 HCAR2 (0.38) HCAR2ALDH1A1LMNAESR1CHRM1
SCHEMBL966812 0.72 TSHR (0.37) HCAR2LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2280057-B2 LUBRICATING OIL COMPOSITION FOR INTERNAL COMBUSTION ENGINE IDEMITSU KOSAN CO (JP) 2016-11-23 EP disclosed
US-9321981-B2 Lubricating oil composition for internal combustion engine IDEMITSU KOSAN CO., LTD. (JP) 2016-04-26 US disclosed
EP-2280057-B1 LUBRICATING OIL COMPOSITION FOR INTERNAL COMBUSTION ENGINE IDEMITSU KOSAN CO (JP) 2013-09-11 EP disclosed
EP-2280057-A1 LUBRICATING OIL COMPOSITION FOR INTERNAL COMBUSTION ENGINE Idemitsu Kosan Co., Ltd. (JP) 2011-02-02 EP disclosed
US-20110021393-A1 LUBRICATING OIL COMPOSITION FOR INTERNAL COMBUSTION ENGINE IDEMITSU KOSAN CO., LTD. (JP) 2011-01-27 US disclosed