SCHEMBL6691013

SCHEMBL6691013

CCCCOc1ccc2nc(S)sc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
KMT2A Q03164 3/20 0.52
HSD17B10 Q99714 3/20 0.52
ALDH1A1 P00352 2/20 0.52
TP53 P04637 2/20 0.52
CYP3A4 P08684 2/20 0.52
LMNA P02545 3/20 0.51
CYP1A2 P05177 2/20 0.49
CYP2D6 P10635 2/20 0.49
CA1 P00915 3/20 0.47
CA2 P00918 3/20 0.47
CA4 P22748 2/20 0.47
KDM4E B2RXH2 1/20 0.47
CA12 O43570 1/20 0.47
CA3 P07451 1/20 0.47
PKM P14618 1/20 0.47
CA6 P23280 1/20 0.47
CA5A P35218 1/20 0.47
CA7 P43166 1/20 0.47
HIF1A Q16665 1/20 0.47

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
SCHEMBL10626206 0.94 LMNA (0.57) TSHRKMT2AHSD17B10ALDH1A1TP53
SCHEMBL6690420 0.88 ATP4A (0.44) TSHRKMT2AHSD17B10ALDH1A1TP53
SCHEMBL346596 0.88 KMT2A (0.68) TSHRKMT2AHSD17B10ALDH1A1TP53
SCHEMBL28028162 0.85 ATP4A (0.42) TSHRALDH1A1KDM4EATP4AATP4B
SCHEMBL10425847 0.85 CA1 (0.61) TSHRKMT2AHSD17B10ALDH1A1TP53
SCHEMBL10383598 0.84 NR5A1 (0.43) TSHRTP53ATP4AATP4B
SCHEMBL14093807 0.84 NR5A1 (0.43) TSHRTP53ATP4AATP4B
Isobutane SCHEMBL8361660 0.84 KMT2A (0.62) TSHRKMT2AHSD17B10ALDH1A1TP53
SCHEMBL12111155 0.83 TDP1 (0.57) TSHRKMT2AHSD17B10ALDH1A1TP53
SCHEMBL16155847 0.83 KMT2A (0.54) TSHRKMT2AHSD17B10ALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4724072-A 2-MERCAPTOBENZOTHIAZOLE DERIVATIVES CONSIGLIO NAZIONALE DELLE RICERCHE (IT) 1988-02-09 US claimed
EP-0869016-B1 Pneumatic radial tires BRIDGESTONE CORP (JP) 2004-03-03 EP disclosed
EP-0945482-B1 Rubber composition for tire tread and pneumatic tire using same BRIDGESTONE CORP (JP) 2004-01-28 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-6242522-B1 A DIENE BASED SYNTHETIC RUBBER OR NATURAL RUBBER BLEND CONTAINING BUTADIENE-STYRENE RUBBER, ALUMINUM HYDROXIDE POWDER, SILICA POWDER, CARBON BLACK; LOW FUEL CONSUMPTION AND WEAR RESISTANCE; IMPROVED GRIPPING IN WET AND COLD SITUATIONS BRIDGESTONE CORPORATION (JP) 2001-06-05 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-0948029-A2 High pressure discharge lamp NGK INSULATORS, LTD. (JP) 1999-10-06 EP 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
US-4946585-A USING MERCAPTOBENZOTHIAZOLE AMERICAN CYANAMID COMPANY (US) 1990-08-07 US disclosed
US-4724072-A 2-MERCAPTOBENZOTHIAZOLE DERIVATIVES CONSIGLIO NAZIONALE DELLE RICERCHE (IT) 1988-02-09 US disclosed