SCHEMBL4014482

SCHEMBL4014482

Cc1ccc(Oc2ncccc2C2=CCN(C(=O)O)CC2)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 3/20 0.44
TRPV1 Q8NER1 3/20 0.41
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
RAB9A P51151 1/20 0.38
MAPT P10636 2/20 0.37
CCNT1 O60563 1/20 0.36
CDK9 P50750 1/20 0.36
SCD O00767 1/20 0.36
SCD5 Q86SK9 1/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
PTAFR P25105 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
SCHEMBL4555950 0.92 PDE10A (0.44) PDE10ATRPV1ALDH1A1SMN1; SMN2MAPT
SCHEMBL4009241 0.88 PDE10A (0.44) PDE10ATRPV1ALDH1A1SMN1; SMN2CCNT1
SCHEMBL4007130 0.88 PDE10A (0.55) PDE10A
SCHEMBL4017987 0.85 PDE10A (0.45) PDE10ATRPV1ALDH1A1SMN1; SMN2KMT2A
SCHEMBL4009606 0.82 MAPT (0.45) PDE10AMAPTCCNT1CDK9
SCHEMBL4007141 0.82 PDE10A (0.42) PDE10ATRPV1MAPTCCNT1CDK9
SCHEMBL4015332 0.81 PDE10A (0.51) PDE10AALDH1A1SMN1; SMN2MAPTCCNT1
SCHEMBL4014684 0.81 PDE10A (0.56) PDE10AALDH1A1SMN1; SMN2
SCHEMBL16992066 0.81 PDE10A (0.46) PDE10AALDH1A1SMN1; SMN2CCNT1CDK9
SCHEMBL4013658 0.80 CCNT1 (0.47) CCNT1CDK9

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-2009081259-A1 PHENOXY-PYRIDYL DERIVATIVES PFIZER INC. (US) 2009-07-02 WO disclosed