SCHEMBL6639769

SCHEMBL6639769

C/C(=N\NC(=O)c1cccc2ccccc12)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.65
RAB9A P51151 9/20 0.65
KMT2A Q03164 6/20 0.65
MEN1 O00255 5/20 0.65
POLB P06746 2/20 0.65
AGTR1 P30556 1/20 0.65
KDM4E B2RXH2 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
MAPT P10636 2/20 0.58
PKM P14618 1/20 0.58
SMN1; SMN2 Q16637 6/20 0.57
PLK1 P53350 1/20 0.57
CTDSP1 Q9GZU7 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
NFKB1 P19838 1/20 0.56
CYP2C19 P33261 1/20 0.56
CASP3 P42574 1/20 0.56
NFKB2 Q00653 1/20 0.56
RELA Q04206 1/20 0.56

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
SCHEMBL1563625 1.00 NPC1 (0.65) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL1563626 1.00 NPC1 (0.65) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL27178094 0.89 NPC1 (0.60) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL27178018 0.89 KMT2A (0.67) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL27178011 0.89 KMT2A (0.67) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL27178104 0.89 NPC1 (0.60) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL1563557 0.86 RAB9A (0.56) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL1561989 0.86 KMT2A (0.66) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL31622511 0.86 KMT2A (0.66) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL27178102 0.85 ATM (0.73) NPC1RAB9AKMT2AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0909788-B1 RUBBER COMPOSITION AND PNEUMATIC TIRES BRIDGESTONE CORP (JP) 2004-12-01 EP disclosed
EP-1420044-A2 Rubber composition and pneumatic tire Bridgestone Corporation (JP) 2004-05-19 EP disclosed
US-6380288-B1 LOW HEAT GENERATION PROPERTY, AGING REISTANCE, ALSO FOR PRODUCING VIBRATION ISOLATORS, BELTS AND HOSES AS WELL AS TIRE MATERIALS SUCH AS TIRE TREADS, UNDERTREADS, CARCASSES, SIDE WALLS AND BEADS BRIDGESTONE CORPORATION 2002-04-30 US disclosed
EP-0909788-A1 RUBBER COMPOSITION AND PNEUMATIC TIRES Bridgestone Corporation (JP) 1999-04-21 EP disclosed