SCHEMBL7901284

SCHEMBL7901284

Cc1ccc(N2C=Cc3ccccc3C2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.42
MAPT P10636 6/20 0.42
NPC1 O15118 5/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
PKM P14618 2/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
ALDH1A1 P00352 3/20 0.38
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
TLR9 Q9NR96 1/20 0.37
TSHR P16473 1/20 0.36
HSD17B3 P37058 1/20 0.36
PARP1 P09874 1/20 0.35
NAMPT P43490 1/20 0.35
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
TAS1R2 Q8TE23 1/20 0.35

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
SCHEMBL29809356 1.00 RAB9A (0.42) RAB9AMAPTNPC1SMN1; SMN2PKM
SCHEMBL1553150 0.87 NPC1 (0.44) RAB9AMAPTNPC1SMN1; SMN2PKM
SCHEMBL30284584 0.87 NPC1 (0.44) RAB9AMAPTNPC1SMN1; SMN2PKM
SCHEMBL28248906 0.86 MAPT (0.51) RAB9AMAPTNPC1SMN1; SMN2PKM
SCHEMBL30633069 0.85 NPC1 (0.43) RAB9AMAPTNPC1SMN1; SMN2MEN1
SCHEMBL28153735 0.85 NPC1 (0.43) RAB9AMAPTNPC1SMN1; SMN2MEN1
SCHEMBL31612033 0.85 NPC1 (0.43) RAB9AMAPTNPC1SMN1; SMN2MEN1
SCHEMBL1356606 0.85 NPC1 (0.43) RAB9AMAPTNPC1SMN1; SMN2MEN1
SCHEMBL28029132 0.84 HDAC3 (0.36) RAB9AMAPTNPC1SMN1; SMN2ALDH1A1
SCHEMBL4206262 0.84 KMT2A (0.50) RAB9ANPC1SMN1; SMN2PKMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6187843-B1 BLEND OF RUBBER WITH NITROGEN-CONTAINING COMPOUND BRIDGESTONE CORPORATION (JP) 2001-02-13 US claimed
EP-0752445-A2 Rubber compositions for tire tread Bridgestone Corporation (JP) 1997-01-08 EP claimed
JP-9071686-A None JP disclosed
US-6187843-B1 BLEND OF RUBBER WITH NITROGEN-CONTAINING COMPOUND BRIDGESTONE CORPORATION (JP) 2001-02-13 US disclosed
JP-H0971686-A RUBBER COMPOSITION FOR TIRE TREAD EXHIBITING EXCELLENT GRIPPING PERFORMANCE AND PNEUMATIC TIRE BRIDGESTONE CORP 1997-03-18 JP disclosed
EP-0752445-A2 Rubber compositions for tire tread Bridgestone Corporation (JP) 1997-01-08 EP disclosed