SCHEMBL10869682

SCHEMBL10869682

COc1cc2ccccc2cc1-c1nc2c(=O)[nH]ncc2[nH]1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.43
HSD17B10 Q99714 2/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SLC2A1 P11166 1/20 0.40
TRPA1 O75762 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
DHODH Q02127 1/20 0.40
PARP1 P09874 1/20 0.40
TLR8 Q9NR97 1/20 0.39
PDE2A O00408 1/20 0.39
PDGFRB P09619 1/20 0.39
FGFR1 P11362 1/20 0.39
KDR P35968 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.39
TNKS O95271 1/20 0.38

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
SCHEMBL10688606 0.82 PDE7A (0.48) HTTDHODHPARP1PDE2AFGFR1
SCHEMBL10692684 0.82 ADORA2B (0.46) KDM4EHSD17B10HTTSMN1; SMN2DHODH
SCHEMBL10693845 0.82 GAA (0.43) HSD17B10HTTDHODHPARP1FGFR1
SCHEMBL10869401 0.81 PIM1 (0.49) KDM4EHSD17B10HTTSMN1; SMN2NPC1
SCHEMBL10688582 0.80 PDE5A (0.38) KDM4EHSD17B10HTTSMN1; SMN2NPC1
SCHEMBL10690944 0.79 EGLN2 (0.39) KDM4EHSD17B10HTTSMN1; SMN2DHODH
SCHEMBL10686161 0.79 CDK4 (0.42) KDM4EHSD17B10HTTSMN1; SMN2DHODH
SCHEMBL10686472 0.78 PDE5A (0.37) KDM4EHSD17B10HTTSMN1; SMN2DHODH
SCHEMBL10691563 0.78 CA2 (0.42) KDM4EHSD17B10HTTSMN1; SMN2DHODH
SCHEMBL10691722 0.78 MEN1 (0.38) KDM4EHSD17B10HTTSMN1; SMN2DHODH

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-0184738-A2 Imidazole derivatives, medicaments containing these compounds, and process for their preparation Dr. Karl Thomae GmbH (DE) 1986-06-18 EP disclosed