SCHEMBL3975200

SCHEMBL3975200

Nc1scc(-c2cccc(Cl)c2)c1C(=O)c1ccc(Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 5/20 0.48
HSD17B10 Q99714 2/20 0.48
ALDH1A1 P00352 4/20 0.47
MAPT P10636 3/20 0.47
LMNA P02545 2/20 0.47
ADORA1 P30542 5/20 0.46
RORB Q92753 2/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
RAB9A P51151 1/20 0.44
HPGD P15428 1/20 0.44
MAP4K4 O95819 1/20 0.43
ALOX15 P16050 1/20 0.43
MAPK1 P28482 1/20 0.41
RORC P51449 1/20 0.41

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
SCHEMBL3975112 0.92 PRKCZ (0.50) PRKCZHSD17B10ALDH1A1MAPTLMNA
SCHEMBL3980156 0.88 PRKCZ (0.45) PRKCZHSD17B10ALDH1A1MAPTLMNA
SCHEMBL3975696 0.88 PRKCZ (0.45) PRKCZHSD17B10ALDH1A1MAPTLMNA
SCHEMBL3972011 0.87 PRKCZ (0.57) PRKCZHSD17B10ALDH1A1MAPTLMNA
SCHEMBL3974360 0.86 PRKCZ (0.62) PRKCZHSD17B10ALDH1A1MAPTLMNA
SCHEMBL3979210 0.85 MAPT (0.69) PRKCZHSD17B10ALDH1A1MAPTLMNA
SCHEMBL3972275 0.85 RORB (0.49) PRKCZHSD17B10ALDH1A1MAPTLMNA
SCHEMBL12466203 0.85 HSD17B10 (0.51) PRKCZHSD17B10ALDH1A1MAPTLMNA
SCHEMBL3974076 0.84 MAPT (0.62) PRKCZHSD17B10ALDH1A1MAPTLMNA
SCHEMBL3976107 0.82 PRKCZ (0.58) PRKCZHSD17B10ALDH1A1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009049362-A1 A1 ADENOSINE RECEPTOR ALLOSTERIC ENHANCERS MONASH UNIVERSITY (AU) 2009-04-23 WO claimed
WO-2009049362-A1 A1 ADENOSINE RECEPTOR ALLOSTERIC ENHANCERS MONASH UNIVERSITY (AU) 2009-04-23 WO disclosed
WO-2009049362-A1 A1 ADENOSINE RECEPTOR ALLOSTERIC ENHANCERS MONASH UNIVERSITY (AU) 2009-04-23 WO disclosed