SCHEMBL13073089

SCHEMBL13073089

CNNC(=O)c1cc(Cl)cc(C)c1NC(=O)c1ccc(Br)n1-c1ncccn1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.36
DRD4 P21917 1/20 0.34
GRM4 Q14833 4/20 0.33
GFER P55789 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
RAB9A P51151 2/20 0.31
GAA P10253 1/20 0.31
CYP11B2 P19099 1/20 0.31
NPC1 O15118 1/20 0.31
PSD A5PKW4 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
S1PR4 O95977 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL12528663 0.92 F10 (0.37) F10DRD4GRM4MEN1KMT2A
SCHEMBL12911742 0.91 F10 (0.35) F10DRD4GRM4MEN1KMT2A
SCHEMBL12559225 0.90 ALDH1A1 (0.38) F10DRD4GRM4MEN1KMT2A
SCHEMBL950777 0.89 P2RX7 (0.38) F10DRD4GRM4MEN1KMT2A
SCHEMBL12528659 0.81 MALT1 (0.38) F10DRD4GRM4RAB9ANPC1
SCHEMBL12911739 0.81 MALT1 (0.36) F10DRD4GRM4MEN1KMT2A
SCHEMBL13072535 0.79 ALDH1A1 (0.38) F10GRM4MEN1KMT2AALDH1A1
SCHEMBL951419 0.78 MALT1 (0.38) F10DRD4GRM4PSDNPSR1
SCHEMBL12912066 0.77 DHODH (0.44) F10DRD4GFERRAB9AGAA
SCHEMBL14495039 0.77 GFER (0.37) F10GRM4GFERMEN1KMT2A

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-2251336-A1 Hydrazide compounds as intermediates of pesticides Sumitomo Chemical Company, Limited (JP) 2010-11-17 EP disclosed