SCHEMBL6902202

SCHEMBL6902202

CCOc1ccc2nc(Sc3nc4ccc(OCC)cc4s3)sc2c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.66
LMNA P02545 5/20 0.66
L3MBTL1 Q9Y468 3/20 0.66
MAPK1 P28482 1/20 0.66
KMT2A Q03164 6/20 0.66
ALDH1A1 P00352 4/20 0.66
CYP3A4 P08684 2/20 0.66
HSD17B10 Q99714 2/20 0.66
TP53 P04637 1/20 0.66
TSHR P16473 1/20 0.66
PPARA Q07869 4/20 0.64
TDP1 Q9NUW8 3/20 0.64
HTT P42858 2/20 0.64
KDM4E B2RXH2 1/20 0.58
CA12 O43570 1/20 0.58
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
CA3 P07451 1/20 0.58
PKM P14618 1/20 0.58
CA4 P22748 1/20 0.58

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
SCHEMBL6689290 0.91 PDK1 (0.69) MAPTLMNAL3MBTL1MAPK1KMT2A
SCHEMBL6665955 0.89 MAPT (0.64) MAPTLMNAL3MBTL1MAPK1KMT2A
SCHEMBL8361511 0.89 MAPT (0.63) MAPTLMNAL3MBTL1MAPK1KMT2A
SCHEMBL10475190 0.88 ALDH1A1 (0.67) MAPTLMNAL3MBTL1MAPK1KMT2A
SCHEMBL6900878 0.88 PDK1 (0.54) MAPTLMNAL3MBTL1MAPK1KMT2A
SCHEMBL6900275 0.88 MAPT (0.52) MAPTLMNAL3MBTL1MAPK1KMT2A
SCHEMBL8356256 0.87 KMT2A (0.65) MAPTLMNAL3MBTL1MAPK1KMT2A
SCHEMBL11590891 0.87 KMT2A (0.59) MAPTLMNAL3MBTL1MAPK1KMT2A
SCHEMBL8358196 0.87 MAPT (0.71) MAPTLMNAL3MBTL1MAPK1KMT2A
SCHEMBL8358167 0.85 PPARA (0.73) MAPTLMNAL3MBTL1MAPK1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0945482-B1 Rubber composition for tire tread and pneumatic tire using same BRIDGESTONE CORP (JP) 2004-01-28 EP 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
EP-0948029-A2 High pressure discharge lamp NGK INSULATORS, LTD. (JP) 1999-10-06 EP disclosed