SCHEMBL9328408

SCHEMBL9328408

COC(=O)C(C)=CC(C)=Cc1cc([N+](=O)[O-])ccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
HTT P42858 2/20 0.43
GAA P10253 3/20 0.42
HSD17B10 Q99714 1/20 0.42
KMT2A Q03164 4/20 0.42
LMNA P02545 1/20 0.42
RORC P51449 1/20 0.41
MEN1 O00255 2/20 0.40
PKM P14618 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
RAB9A P51151 1/20 0.40
MAPK1 P28482 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL9329170 0.90 MAPT (0.48) MAPTHTTGAAHSD17B10KMT2A
SCHEMBL9307151 0.90 MAPT (0.52) MAPTHTTGAAHSD17B10KMT2A
SCHEMBL9307154 0.90 MAPT (0.52) MAPTHTTGAAHSD17B10KMT2A
SCHEMBL9330256 0.86 MAPT (0.51) MAPTHTTHSD17B10KMT2ALMNA
SCHEMBL11553203 0.82 MAPT (0.50) MAPTHTTGAAHSD17B10KMT2A
SCHEMBL7913986 0.82 MAPT (0.52) MAPTHTTGAAHSD17B10KMT2A
SCHEMBL7913985 0.82 MAPT (0.52) MAPTHTTGAAHSD17B10KMT2A
SCHEMBL9331247 0.81 KMT2A (0.52) MAPTHTTGAAHSD17B10KMT2A
SCHEMBL9330347 0.81 GAA (0.37) MAPTGAAHSD17B10KMT2ALMNA
SCHEMBL9657004 0.81 MAPT (0.51) MAPTHTTHSD17B10KMT2ALMNA

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-0300387-B1 Phenyl alkenylcarboxylic acids and their esters BASF AG (DE) 1994-03-23 EP disclosed
US-5123955-A Herbicides, chloro and tetrahydrophthalimido-substituted phenyl PLATH PETER (DE) 1992-06-23 US disclosed
US-4933001-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1990-06-12 US disclosed
EP-0300387-A2 Phenyl alkenylcarboxylic acids and their esters BASF Aktiengesellschaft (DE) 1989-01-25 EP disclosed