SCHEMBL6690979

SCHEMBL6690979

CCCCOc1ccc2sc(SSc3nc4cc(OCCCC)ccc4s3)nc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 2/20 0.50
FBP1 P09467 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
ALDH1A1 P00352 1/20 0.44
ADRA2A P08913 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
DRD2 P14416 1/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.44
ADRA2B P18089 1/20 0.44
ADRA2C P18825 1/20 0.44
DRD1 P21728 1/20 0.44
MC5R P33032 1/20 0.44
OPRM1 P35372 1/20 0.44
DRD3 P35462 1/20 0.44
OPRK1 P41145 1/20 0.44
CCR2 P41597 1/20 0.44
HTR6 P50406 1/20 0.44
SLC6A3 Q01959 1/20 0.44
HSD17B10 Q99714 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
SCHEMBL6900180 0.91 PPARA (0.43) TDP1PPARAATP4AATP4BMAPT
SCHEMBL8651907 0.89 ATP4A (0.44) TDP1ALDH1A1HSD17B10PPARAATP4A
SCHEMBL6691987 0.88 PDK1 (0.66) PDK1TDP1ALDH1A1HPGDHSD17B10
SCHEMBL6690610 0.88 PDK1 (0.53) PDK1FBP1TDP1ALDH1A1ADRA2A
SCHEMBL6694325 0.85 PPARA (0.42) TDP1PPARAATP4AATP4BMAPT
SCHEMBL6690919 0.83 PPARA (0.43) TDP1PPARAATP4AATP4BMAPT
SCHEMBL12111148 0.82 PDE10A (0.56) TDP1ALDH1A1HPGDHSD17B10ATP4A
SCHEMBL17324193 0.81 NCF1 (0.43) PDK1FBP1TDP1ALDH1A1ADRA2A
SCHEMBL6690420 0.81 ATP4A (0.44) ALDH1A1DRD2HPGDDRD3HSD17B10
SCHEMBL23457607 0.80 CYP1A2 (0.38) ALDH1A1HPGDPPARAATP4AATP4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0869016-B1 Pneumatic radial tires BRIDGESTONE CORP (JP) 2004-03-03 EP disclosed
EP-0890605-B1 Pneumatic tire BRIDGESTONE CORP (JP) 2003-04-23 EP disclosed
EP-1277795-A2 Pneumatic tire BRIDGESTONE CORPORATION (JP) 2003-01-22 EP disclosed
US-20020010283-A1 RUBBER COMPOSITION BRIDGESTONE CORPORATION (JP) 2002-01-24 US disclosed
US-6336486-B1 Pneumatic radical tire having cap base tread BRIDGESTONE CORPORATION (JP) 2002-01-08 US disclosed
US-6186204-B1 EXCELLENT STABILITY AND CONTROLLABILITY ON WET ROADS OR A COMBINATION OF STABILITY AND CONTROLLABILITY ON WET ROADS AND EXCELLENT COMFORT OF RIDE EVEN WHEN A VEHICLE IS VIBRATING THROUGHOUT THE LIFE OF THE PNEUMATIC TIRE BRIDGESTONE CORPORATION (JP) 2001-02-13 US disclosed
EP-0890605-A2 Pneumatic tire BRIDGESTONE CORPORATION (JP) 1999-01-13 EP disclosed
EP-0869016-A2 Pneumatic radial tires Bridgestone Corporation (JP) 1998-10-07 EP disclosed
EP-0854168-A1 Rubber composition Bridgestone Corporation (JP) 1998-07-22 EP disclosed