Charcoal, Activated

Charcoal, Activated

SCHEMBL8610664

O=Nc1ccccc1N=O.[C]

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.36
MAPT P10636 4/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
LMNA P02545 3/20 0.36
KDM4E B2RXH2 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
RAB9A P51151 3/20 0.36
HTT P42858 2/20 0.36
GAA P10253 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 6/20 0.35
ALOX15 P16050 1/20 0.35
TDP1 Q9NUW8 2/20 0.35
CYP3A4 P08684 2/20 0.35
HSP90AA1 P07900 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CA12 O43570 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL234460 0.96 NPC1 (0.38) NPC1MAPTL3MBTL1LMNAKDM4E
SCHEMBL30307825 0.96 NPC1 (0.38) NPC1MAPTL3MBTL1LMNAKDM4E
Naphthalene SCHEMBL27361432 0.87 CYP2A6 (0.50) NPC1MAPTL3MBTL1LMNAKDM4E
Nitrosobenzene SCHEMBL28826068 0.82 ALDH1A1 (0.50) NPC1MAPTL3MBTL1LMNAKDM4E
SCHEMBL17146388 0.82 CA12 (0.33) NPC1MAPTL3MBTL1LMNAKDM4E
SCHEMBL28224749 0.80 MEN1 (0.40) NPC1MAPTL3MBTL1LMNAKDM4E
Phenol SCHEMBL28199445 0.80 TDP1 (0.58) NPC1MAPTLMNAKDM4ESMN1; SMN2
SCHEMBL2128307 0.78
SCHEMBL19685108 0.78 NPC1 (0.39) NPC1MAPTL3MBTL1LMNAKDM4E
SCHEMBL24660121 0.76 ALDH1A1 (0.52) LMNAALDH1A1ALOX15TDP1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1069103-C Aqueous adhesive compositions LORD CORP (US) 2001-08-01 CN disclosed
CN-1188491-A Aqueous adhesive compositions LORD CORP (US) 1998-07-22 CN disclosed
EP-0836630-A2 AQUEOUS ADHESIVE COMPOSITIONS LORD CORPORATION (US) 1998-04-22 EP disclosed
US-5717031-A VULCANIZED ELASTOMERIC RUBBER PORTION CONSISTS OF SUBSTRATE, VULCANIZABLE ELASTOMERIC RUBBER, AN ADHESIVE LAYER IN BETWEEN, ADHESIVE COMPRISES WATER DISPERSABLE POLYISOCYANATE, A HALOGENATED POLYOLEFIN AND CURING AGENT LORD CORPORATION (US) 1998-02-10 US disclosed
WO-1997000904-A2 AQUEOUS ADHESIVE COMPOSITIONS LORD CORPORATION (US) 1997-01-09 WO disclosed