SCHEMBL20406552

SCHEMBL20406552

FC(F)(F)Sc1ccc(Oc2ncccc2Br)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 6/20 0.44
▸ PTPRZ1 P23471 1/20 0.44
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ DRD1 P21728 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 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
SCHEMBL20406219 0.83 PDE10A (0.46) PDE10AALDH1A1MAPTATM
SCHEMBL4008297 0.81 PDE10A (0.45) PDE10ANPC1RAB9AALDH1A1MAPT
SCHEMBL31395515 0.79 PDE10A (0.53) PDE10ASMN1; SMN2DRD1KMT2A
SCHEMBL20406196 0.79 PDE10A (0.43) PDE10AALDH1A1MAPTATMDRD1
SCHEMBL4008329 0.77 PDE10A (0.51) PDE10AALDH1A1MAPTDRD1TDP1
SCHEMBL20406262 0.77 PDE10A (0.42) PDE10AALDH1A1MAPTATMDRD1
SCHEMBL20406612 0.76 PDE10A (0.48) PDE10ANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL20406238 0.76 PDE10A (0.48) PDE10ARAB9AALDH1A1MAPTATM
SCHEMBL20406610 0.76 PDE10A (0.51) PDE10ARAB9ADRD1TDP1MEN1
SCHEMBL7910614 0.76 KMT2A (0.59) PDE10ASMN1; SMN2ALDH1A1MAPTDRD1

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
EP-3351533-A1 BIARYL DERIVATIVE AND MEDICINE CONTAINING SAME Kaken Pharmaceutical Co., Ltd. (JP) 2018-07-25 — — EP disclosed
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