SCHEMBL4400124

SCHEMBL4400124

Cn1c(-c2ccncc2O)nc2cc(C(F)(F)F)ccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 3/20 0.45
PDE2A O00408 2/20 0.45
PDE7A Q13946 1/20 0.45
HTR2B P41595 1/20 0.45
HTR6 P50406 1/20 0.45
AGPAT2 O15120 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
POLB P06746 1/20 0.43
KIT P10721 2/20 0.42
PIK3CA P42336 1/20 0.39
PIK3CB P42338 1/20 0.39
PIK3CG P48736 1/20 0.39
ATM Q13315 1/20 0.39
PKM P14618 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
KDM4E B2RXH2 2/20 0.37
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL356013 0.88 PDE10A (0.58) PDE10APDE2APDE7AHTR2BHTR6
SCHEMBL167106 0.86 PDE10A (0.46) PDE10APDE2APDE7AHTR2BHTR6
SCHEMBL4401183 0.86 PDE10A (0.46) PDE10APDE2APDE7AHTR2BHTR6
SCHEMBL169419 0.85 AGPAT2 (0.48) PDE10APDE2APDE7AHTR2BHTR6
SCHEMBL13075054 0.83 POLB (0.44) PDE10APDE2APDE7AHTR2BHTR6
SCHEMBL168094 0.83 PDE10A (0.43) PDE10APDE2APDE7AHTR2BHTR6
SCHEMBL169465 0.83 POLB (0.55) PDE10APDE2APDE7AHTR2BHTR6
SCHEMBL169484 0.83 PDE10A (0.46) PDE10APDE2APDE7AHTR2BHTR6
SCHEMBL10284936 0.82 PDE10A (0.43) PDE10APDE2APDE7AHTR2BHTR6
SCHEMBL355691 0.82 POLB (0.44) PDE10APDE2APDE7AHTR2BHTR6

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
WO-2012057260-A1 PEST CONTROL COMPOSITION AND METHOD FOR CONTROLLING PESTS 住友化学株式会社 (JP) 2012-05-03 WO disclosed
WO-2012057268-A1 PEST CONTROL COMPOSITION AND METHOD FOR CONTROLLING PESTS 住友化学株式会社 (JP) 2012-05-03 WO disclosed
WO-2012057264-A1 PEST CONTROL COMPOSITION AND METHOD FOR CONTROLLING PESTS 住友化学株式会社 (JP) 2012-05-03 WO disclosed
WO-2012057265-A1 PEST CONTROL COMPOSITION AND METHOD FOR CONTROLLING PESTS 住友化学株式会社 (JP) 2012-05-03 WO disclosed
WO-2012057266-A1 PEST CONTROL COMPOSITION AND METHOD FOR CONTROLLING PESTS 住友化学株式会社 (JP) 2012-05-03 WO disclosed
WO-2012057273-A1 HARMFUL ANIMAL CONTROL COMPOSITION AND METHOD FOR CONTROLLING HARMFUL ANIMALS 住友化学株式会社 (JP) 2012-05-03 WO disclosed
WO-2012057269-A1 HARMFUL ANIMAL CONTROL COMPOSITION AND METHOD FOR CONTROLLING HARMFUL ANIMALS 住友化学株式会社 (JP) 2012-05-03 WO disclosed