SCHEMBL4583334

SCHEMBL4583334

Cc1n[nH]c(=O)c(-c2ccccc2Cl)c1-c1ccc(Cl)s1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.38
DRD1 P21728 1/20 0.37
KMT2A Q03164 4/20 0.36
HSP90AA1 P07900 1/20 0.36
POLB P06746 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 3/20 0.35
ALDH1A1 P00352 2/20 0.35
NR1H2 P55055 1/20 0.35
NR1H3 Q13133 1/20 0.35
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
HSD17B10 Q99714 1/20 0.34
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
PGR P06401 1/20 0.33
GRIN2D O15399 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
SCHEMBL4582585 0.87 GNRHR (0.37) NOTUMKMT2AHSP90AA1NPSR1L3MBTL1
SCHEMBL4582481 0.86 NPSR1 (0.36) DRD1KMT2APOLBNPSR1L3MBTL1
SCHEMBL4584726 0.83 TYMP (0.45) NOTUMDRD1KMT2AHSP90AA1POLB
SCHEMBL4582299 0.83 NPSR1 (0.37) DRD1NPSR1L3MBTL1
SCHEMBL4608946 0.79 TYMP (0.46) KMT2APOLBNPSR1L3MBTL1MEN1
SCHEMBL4582968 0.77 USP1 (0.33) DRD1
SCHEMBL4582691 0.77 IKBKE (0.45) NOTUMKMT2APOLBNPSR1L3MBTL1
SCHEMBL4584403 0.77 HSD11B1 (0.38) KMT2APOLBL3MBTL1ALDH1A1HSD17B10
SCHEMBL4582132 0.76 DRD1 (0.34) DRD1NPSR1L3MBTL1PGR
SCHEMBL19467743 0.74 DRD1 (0.38) NOTUMDRD1KMT2AHSP90AA1POLB

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-1972623-A1 Arylpyridazines as fungicides Bayer CropScience AG (DE) 2008-09-24 EP disclosed