SCHEMBL7829236

SCHEMBL7829236

OCCCCc1cc(Oc2ccc(Cl)cc2)n2nccc2n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.40
PDE10A Q9Y233 3/20 0.37
AGER Q15109 2/20 0.35
KCNH2 Q12809 1/20 0.34
CCNT1 O60563 1/20 0.32
CDK7 P50613 1/20 0.32
CDK9 P50750 1/20 0.32
CCNH P51946 1/20 0.32
KCNN3 Q9UGI6 3/20 0.32
P2RX3 P56373 4/20 0.32
SIRT2 Q8IXJ6 1/20 0.32
PRKAB2 O43741 1/20 0.31
PRKAG1 P54619 1/20 0.31
PRKAA2 P54646 1/20 0.31
PRKAA1 Q13131 1/20 0.31
PRKAG3 Q9UGI9 1/20 0.31
PRKAG2 Q9UGJ0 1/20 0.31
PRKAB1 Q9Y478 1/20 0.31
CRHR1 P34998 1/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL7834964 0.88 PDE10A (0.41) LOXL2PDE10AKCNH2CCNT1CDK7
SCHEMBL7835390 0.88 LOXL2 (0.51) LOXL2PDE10ACCNT1CDK7CDK9
SCHEMBL7835475 0.88 LOXL2 (0.47) LOXL2PDE10AKCNH2KCNN3KMT2A
SCHEMBL7831740 0.85 S1PR4 (0.36) LOXL2PDE10ALMNA
SCHEMBL7830382 0.84 KDM5A (0.40) PDE10AKCNN3PRKAB2PRKAG1PRKAA2
SCHEMBL7833197 0.83 LOXL2 (0.40) LOXL2PDE10ACDK7CDK9KCNN3
SCHEMBL7833855 0.82 LOXL2 (0.39) LOXL2PDE10ACCNT1CDK7CDK9
SCHEMBL7832213 0.81 LOXL2 (0.38) LOXL2PDE10AKCNN3CRHR1KCNN1
SCHEMBL7829335 0.80 PDE10A (0.38) LOXL2PDE10ACCNT1CDK7CDK9
SCHEMBL7834870 0.78 P2RX7 (0.39) LOXL2PDE10AKCNN3PRKAB2PRKAG1

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
EP-0820997-B1 PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES OTSUKA PHARMA CO LTD (JP) 2001-07-25 EP disclosed
US-5985882-A ANALGESICS OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1999-11-16 US disclosed
EP-0820997-A1 PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1998-01-28 EP disclosed