Chloroneb

Chloroneb

SCHEMBL23037464

COc1cc(Cl)c(OC)cc1Cl.O=[N+]([O-])c1cc([N+](=O)[O-])c2ccccc2c1Cl

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.50
ALDH1A1 P00352 4/20 0.49
TDP1 Q9NUW8 2/20 0.49
MAPT P10636 5/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
HPGD P15428 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
MAPK1 P28482 2/20 0.42
TSHR P16473 1/20 0.42
PIN1 Q13526 1/20 0.41
HPRT1 P00492 1/20 0.41

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
SCHEMBL29378223 0.84 TDP1 (0.54) LMNAALDH1A1TDP1MAPTSMN1; SMN2
SCHEMBL414254 0.84 TDP1 (0.54) LMNAALDH1A1TDP1MAPTSMN1; SMN2
Chloroneb SCHEMBL4396425 0.79 LMNA (0.46) LMNAALDH1A1TDP1MAPTSMN1; SMN2
SCHEMBL15302617 0.76 TDP1 (0.50) LMNAALDH1A1TDP1MAPTSMN1; SMN2
SCHEMBL2874199 0.76 LMNA (0.50) LMNAALDH1A1TDP1MAPTSMN1; SMN2
SCHEMBL31188768 0.76 LMNA (0.54) LMNAALDH1A1TDP1MAPTSMN1; SMN2
SCHEMBL310130 0.76 LMNA (0.54) LMNAALDH1A1TDP1MAPTSMN1; SMN2
Methyl Alcohol SCHEMBL28097248 0.73 LMNA (0.55) LMNAALDH1A1TDP1MAPTSMN1; SMN2
SCHEMBL11369996 0.73 MAPK1 (0.51) LMNAALDH1A1TDP1MAPTSMN1; SMN2
SCHEMBL10814747 0.73 ALDH1A1 (0.51) LMNAALDH1A1TDP1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3784039-A1 RHEOLOGICAL MODIFIERS FOR SPRAY DRIFT CONTROL IN AGROCHEMICAL EMULSIONS Rohm and Haas Company (US) 2021-03-03 EP disclosed