SCHEMBL10099698

SCHEMBL10099698

COc1cccc(-c2c[nH]c(CCl)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
MAPT P10636 5/20 0.49
LMNA P02545 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
KDM4E B2RXH2 2/20 0.49
DCUN1D1 Q96GG9 1/20 0.46
DYRK1A Q13627 2/20 0.44
CLK4 Q9HAZ1 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
CYP19A1 P11511 1/20 0.43
RAB9A P51151 2/20 0.43
ALDH1A1 P00352 2/20 0.43
ADORA2A P29274 1/20 0.43
ADORA1 P30542 1/20 0.43
DYRK1B Q9Y463 1/20 0.43
NR1H2 P55055 1/20 0.43
NR1H3 Q13133 1/20 0.43
NFKB1 P19838 1/20 0.43

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
SCHEMBL10099697 0.85 PDGFRB (0.50) PDGFRBKITKDRMAPTDCUN1D1
SCHEMBL8655680 0.80 MAOB (0.47) PDGFRBKITKDRDCUN1D1DYRK1A
SCHEMBL28289637 0.78 PDGFRB (0.54) PDGFRBKITKDRMAPTDCUN1D1
SCHEMBL16481876 0.78 PDGFRB (0.54) PDGFRBKITKDRMAPTLMNA
SCHEMBL259080 0.77 KDM4E (0.42) PDGFRBMAPTLMNAKDM4ESMN1; SMN2
SCHEMBL17843990 0.77 MKNK1 (0.53) PDGFRBKITKDRMAPTKDM4E
SCHEMBL14736598 0.76 MAPT (0.52) PDGFRBKITKDRMAPTKDM4E
SCHEMBL7146244 0.76 NR1H2 (0.58) PDGFRBKITKDRMAPTTDP1
SCHEMBL15987710 0.74 PDGFRB (0.50) PDGFRBKITKDRDCUN1D1DYRK1A
SCHEMBL10099715 0.74 PDGFRB (0.48) PDGFRBKITKDRMAPTTDP1

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
WO-2012007006-A1 TRIAZOLO- AND PYRAZOLOQUINAZOLINE DERIVATIVES AS PDE10A ENZYME INHIBITOR H. LUNDBECK A/S (DK) 2012-01-19 WO disclosed