SCHEMBL8037109

SCHEMBL8037109

N#[N+]c1ccc(Cl)cc1.O=[N+]([O-])[O-]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 2/20 0.41
MAPK1 P28482 2/20 0.38
TSHR P16473 2/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
LMNA P02545 2/20 0.36
CYP2A6 P11509 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
VCAM1 P19320 1/20 0.36
ALDH1A1 P00352 5/20 0.36
MAPT P10636 4/20 0.36
HTT P42858 1/20 0.36
CYP3A4 P08684 1/20 0.36
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
CA12 O43570 1/20 0.33
CA3 P07451 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
Nitric Acid SCHEMBL27534898 0.91 FBP1 (0.40) FBP1MAPK1TSHRMEN1KMT2A
SCHEMBL3469053 0.85
Hydrochloric Acid SCHEMBL1578783 0.83 LMNA (0.47) MAPK1TSHRLMNACYP2A6CYP1A2
SCHEMBL38660753 0.83 LMNA (0.47) MAPK1TSHRLMNACYP2A6CYP1A2
Hydrochloric Acid SCHEMBL19358473 0.83 LMNA (0.47) MAPK1TSHRLMNACYP2A6CYP1A2
SCHEMBL10706019 0.83 LMNA (0.47) MAPK1TSHRLMNACYP2A6CYP1A2
Phosphoric Acid SCHEMBL11318475 0.82 LMNA (0.36) MAPK1MEN1KMT2ALMNACYP2A6
SCHEMBL11329675 0.80 LMNA (0.44) MAPK1TSHRLMNACYP2A6CYP1A2
SCHEMBL28106452 0.80 CA1 (0.46) FBP1MAPK1TSHRLMNACYP2A6
SCHEMBL11689983 0.78 FLT1 (0.46) CYP1A2CYP2C9CYP2C19ALDH1A1MAPT

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
WO-2014070987-A1 POROUS CARBON MONOLITHS TEMPLATED BY PICKERING EMULSIONS CABOT CORPORATION (US) 2014-05-08 WO disclosed
US-20140120339-A1 POROUS CARBON MONOLITHS TEMPLATED BY PICKERING EMULSIONS CABOT CORPORATION (US) 2014-05-01 US disclosed
EP-0799282-B1 CARBON MATERIALS REACTED WITH DIAZONIUM SALTS CABOT CORP (US) 2000-04-05 EP disclosed
EP-0799282-A1 CARBON MATERIALS REACTED WITH DIAZONIUM SALTS CABOT CORPORATION (US) 1997-10-08 EP disclosed
US-5554739-A Process for preparing carbon materials with diazonium salts and resultant carbon products CABOT CORPORATION (US) 1996-09-10 US disclosed
WO-1996018690-A1 CARBON MATERIALS REACTED WITH DIAZONIUM SALTS CABOT CORPORATION (US) 1996-06-20 WO disclosed