SCHEMBL370069

SCHEMBL370069

CCc1cc2c3ccccc3nc(CCl)n2n1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 6/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
HSP90AB1 P08238 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39
LMNA P02545 1/20 0.39
TLR7 Q9NYK1 2/20 0.38
ADORA3 P0DMS8 3/20 0.37
ADORA1 P30542 1/20 0.37
RECQL P46063 1/20 0.36
POLB P06746 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL364104 0.83 PDE10A (0.59) PDE10AKMT2AMEN1KDM4E
SCHEMBL9258182 0.75 HTR3E (0.49) PDE10AKMT2AMEN1KDM4EALDH1A1
SCHEMBL18304738 0.74 ADORA2A (0.53) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL31461670 0.71 KDM4E (0.42) PDE10AKMT2AMEN1KDM4EALDH1A1
SCHEMBL31461727 0.71 TSHR (0.42) PDE10AKMT2AMEN1KDM4EALDH1A1
SCHEMBL8357609 0.69 KMT2A (0.46) KMT2AMEN1KDM4EALDH1A1MAPT
SCHEMBL31461679 0.66 KDM4E (0.36) PDE10AKMT2AMEN1KDM4EALDH1A1
SCHEMBL18304786 0.66 ADORA2A (0.53) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL1161180 0.65 LMNA (0.68) KMT2AMEN1KDM4EALDH1A1MAPT
SCHEMBL9315070 0.64 MAOA (0.45) KMT2AKDM4EALDH1A1MAPTHPGD

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