Hexane

Hexane

SCHEMBL1975489

CCCCCC.OP(O)(O)=S.OP(O)(O)=S.OP(O)(O)=S.OP(O)(O)=S

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 10/20 0.55
LPAR2 Q9HBW0 7/20 0.55
TSHR P16473 3/20 0.50
THRB P10828 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.47
LMNA P02545 3/20 0.44
ALDH1A1 P00352 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
FDPS P14324 2/20 0.43
LPAR1 Q92633 3/20 0.43

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
Hexane SCHEMBL1973442 1.00 LPAR3 (0.55) LPAR3LPAR2TSHRTHRBSMN1; SMN2
Hexane SCHEMBL6696473 1.00 LPAR3 (0.55) LPAR3LPAR2TSHRTHRBSMN1; SMN2
Hexane SCHEMBL6700386 1.00 LPAR3 (0.55) LPAR3LPAR2TSHRTHRBSMN1; SMN2
Hexane SCHEMBL6700086 1.00 LPAR3 (0.55) LPAR3LPAR2TSHRTHRBSMN1; SMN2
Hexane SCHEMBL1971634 1.00 LPAR3 (0.55) LPAR3LPAR2TSHRTHRBSMN1; SMN2
Hexane SCHEMBL1051567 1.00 LPAR3 (0.55) LPAR3LPAR2TSHRTHRBSMN1; SMN2
Hexane SCHEMBL1044781 1.00 LPAR3 (0.55) LPAR3LPAR2TSHRTHRBSMN1; SMN2
Hexane SCHEMBL1051046 1.00 LPAR3 (0.55) LPAR3LPAR2TSHRTHRBSMN1; SMN2
Hexane SCHEMBL25229636 0.96 LPAR3 (0.52) LPAR3LPAR2TSHRTHRBSMN1; SMN2
Hexane SCHEMBL345960 0.96 LPAR3 (0.52) LPAR3LPAR2TSHRTHRBSMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1816183-B1 DRIVING FORCE TRANSMITTING SYSTEM AND LUBRICANT COMPOSITION FOR THIS SYSTEM NIPPON OIL CORP (JP) 2011-06-22 EP disclosed
US-20080146474-A1 Lubricant Composition and Driving Force Transmitting System Using Same JTEKT CORPORATION (JP) 2008-06-19 US disclosed
EP-1816183-A1 LUBRICANT COMPOSITION AND DRIVING FORCE TRANSMITTING SYSTEM USING SAME Nippon Oil Corporation (JP) 2007-08-08 EP disclosed
US-20040204325-A1 Transmission fluid compositions for automobiles NIPPON OIL CORPORATION 2004-10-14 US disclosed
US-20040192562-A1 Lubricating oil composition NIPPON OIL CORPORATION 2004-09-30 US disclosed