SCHEMBL4562097

SCHEMBL4562097

C=CCC(C(=O)O)C(S)(S)CC=C

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.36
GRIK2 Q13002 2/20 0.36
CYP2C19 P33261 1/20 0.35
CPA1 P15085 1/20 0.35
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.30

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
SCHEMBL28432687 0.73 PTGS1 (0.45) GRIK1GRIK2CYP2C19ALDH1A1TSHR
SCHEMBL16908675 0.72 CYP2C19 (0.42) GRIK1GRIK2CYP2C19CPA1ALDH1A1
SCHEMBL6202232 0.72 GRIK1 (0.39) GRIK1GRIK2CYP2C19CPA1
SCHEMBL5420620 0.72 GRIK1 (0.39) GRIK1GRIK2CYP2C19CPA1TSHR
SCHEMBL9785440 0.72 GRIK1 (0.39) GRIK1GRIK2CYP2C19CPA1TSHR
SCHEMBL16908693 0.72 CYP2C19 (0.42) GRIK1GRIK2CYP2C19CPA1
SCHEMBL17757012 0.72 GRIK1 (0.39) GRIK1GRIK2CYP2C19CPA1TSHR
SCHEMBL661884 0.72 GRIK1 (0.33) GRIK1GRIK2CYP2C19CPA1ALDH1A1
SCHEMBL4682329 0.71 GRIK1 (0.33) GRIK1GRIK2CYP2C19CPA1ALDH1A1
SCHEMBL15288867 0.71 GRIK1 (0.33) GRIK1GRIK2CYP2C19CPA1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0812900-B1 Lubricating oil composition for automatic transmission IDEMITSU KOSAN CO (JP) 2003-02-19 EP claimed
US-20090292137-A1 ADDITIVE FOR LUBRICATING OIL AND FUEL OIL, LUBRICATING OIL COMPOSITION, AND FUEL OIL COMPOSITION IDEMITSU KOSAN CO., LTD. (JP) 2009-11-26 US disclosed
US-20080045424-A1 Additive for Lubricating Oil and Fuel Oil, Lubricating Oil Composition, and Fuel Oil Composition IDEMITSU KOSAN CO., LTD. (JP) 2008-02-21 US disclosed
EP-1785469-A1 ADDITIVE FOR LUBRICATING OIL AND FUEL OIL, LUBRICATING OIL COMPOSITION, AND FUEL OIL COMPOSITION Idemitsu Kosan Co., Ltd. (JP) 2007-05-16 EP disclosed