SCHEMBL10099697

SCHEMBL10099697

COc1cccc(-c2c[nH]c(CO)n2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.50
KIT P10721 1/20 0.50
KDR P35968 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.46
MAPT P10636 2/20 0.46
DCUN1D1 Q96GG9 1/20 0.46
PLK1 P53350 1/20 0.45
MKNK1 Q9BUB5 1/20 0.44
MKNK2 Q9HBH9 1/20 0.44
PTGDR Q13258 1/20 0.44
ADORA3 P0DMS8 2/20 0.44
ADORA2B P29275 2/20 0.44
ADORA1 P30542 2/20 0.44
ATP4A P20648 1/20 0.44
ATP4B P51164 1/20 0.44
TOP1 P11387 1/20 0.44
ADORA2A P29274 1/20 0.44
DYRK1A Q13627 1/20 0.44
CLK4 Q9HAZ1 1/20 0.44
FYN P06241 2/20 0.44

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
SCHEMBL10099698 0.85 PDGFRB (0.50) PDGFRBKITKDRSMN1; SMN2MAPT
SCHEMBL11048397 0.84 PDGFRB (0.47) PDGFRBSMN1; SMN2MAPTDYRK1AFYN
SCHEMBL11047726 0.80 IDO1 (0.45) ATP4AATP4BGRK6NPC1RAB9A
SCHEMBL8655680 0.80 MAOB (0.47) PDGFRBKITKDRDCUN1D1MKNK1
SCHEMBL14736598 0.79 MAPT (0.52) PDGFRBKITKDRSMN1; SMN2MAPT
SCHEMBL28289637 0.78 PDGFRB (0.54) PDGFRBKITKDRSMN1; SMN2MAPT
SCHEMBL16481876 0.78 PDGFRB (0.54) PDGFRBKITKDRSMN1; SMN2MAPT
SCHEMBL4878975 0.77 NOTUM (0.44) PDGFRBSMN1; SMN2ADORA3ADORA1ADORA2A
SCHEMBL10099715 0.77 PDGFRB (0.48) PDGFRBKITKDRSMN1; SMN2MAPT
SCHEMBL17843990 0.77 MKNK1 (0.53) PDGFRBKITKDRSMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0024829-B1 4-BENZYL- AND 4-BENZOYLIMIDAZOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME Farmos-Yhtyma Oy (FI) 1984-04-25 EP claimed
US-4443466-A DIURETICS, SEDATIVES, ANALGESICS Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) 1984-04-17 US claimed
EP-0024829-A1 4-Benzyl- and 4-benzoylimidazole derivatives, processes for their preparation and pharmaceutical compositions comprising the same Farmos-Yhtyma Oy (FI) 1981-03-11 EP claimed
WO-2012007006-A1 TRIAZOLO- AND PYRAZOLOQUINAZOLINE DERIVATIVES AS PDE10A ENZYME INHIBITOR H. LUNDBECK A/S (DK) 2012-01-19 WO disclosed
EP-0024829-B1 4-BENZYL- AND 4-BENZOYLIMIDAZOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME Farmos-Yhtyma Oy (FI) 1984-04-25 EP disclosed
US-4443466-A DIURETICS, SEDATIVES, ANALGESICS Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) 1984-04-17 US disclosed
EP-0024829-A1 4-Benzyl- and 4-benzoylimidazole derivatives, processes for their preparation and pharmaceutical compositions comprising the same Farmos-Yhtyma Oy (FI) 1981-03-11 EP disclosed