SCHEMBL9795688

SCHEMBL9795688

CCOCCCOc1cccc(N2CC(=O)NC(=O)N2)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ALOX5 P09917 3/20 0.41
DRD2 P14416 1/20 0.39
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
MMP14 P50281 3/20 0.36
PDE3B Q13370 2/20 0.35
PDE3A Q14432 2/20 0.35
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL9795723 0.89 MAPT (0.46) MAPTMEN1KMT2ASMN1; SMN2HSD17B10
SCHEMBL9795640 0.87 PDE3B (0.47) MAPTMEN1KMT2ASMN1; SMN2HSD17B10
SCHEMBL9795565 0.84 MAPT (0.43) MAPTMEN1KMT2ASMN1; SMN2HSD17B10
SCHEMBL9795597 0.79 ALOX5 (0.58) MAPTMEN1KMT2ASMN1; SMN2HSD17B10
SCHEMBL9795653 0.77 ALOX5 (0.54) MAPTMEN1KMT2ASMN1; SMN2HSD17B10
SCHEMBL9795700 0.76 ALOX5 (0.53) MAPTMEN1KMT2AALOX5DDB1
SCHEMBL9796084 0.75 CTSG (0.45) MAPTALOX5DRD2
SCHEMBL9795591 0.75 ALOX5 (0.59) ALOX5DDB1CRBN
SCHEMBL9795641 0.73 ALOX5 (0.60) MAPTHSD17B10ALOX5
SCHEMBL9795515 0.73 ALOX5 (0.47) ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5023255-A Triazine derivatives; inhibitors exzyme 5-lipoxygenase GLAXO GROUP LIMITED (GB) 1991-06-11 US disclosed
EP-0388165-A2 Chemical compounds GLAXO GROUP LIMITED (GB) 1990-09-19 EP disclosed