SCHEMBL20406196

SCHEMBL20406196

CC(F)(F)c1ccc(Oc2ncccc2Br)cc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 6/20 0.43
▸ DRD1 P21728 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ GCK P35557 1/20 0.38
▸ AHR P35869 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
SCHEMBL20406219 0.89 PDE10A (0.46) PDE10AALDH1A1MAPTATMAHR
SCHEMBL20406262 0.82 PDE10A (0.42) PDE10ADRD1MEN1KMT2AALDH1A1
SCHEMBL4008297 0.81 PDE10A (0.45) PDE10ADRD1ALDH1A1MAPTATM
SCHEMBL20406303 0.81 MEN1 (0.46) PDE10ADRD1MEN1KMT2AGCK
SCHEMBL20406170 0.81 PDE10A (0.39) PDE10ADRD1MEN1KMT2AALDH1A1
SCHEMBL20406293 0.81 PDE10A (0.44) PDE10ADRD1MEN1KMT2AALDH1A1
SCHEMBL20406602 0.80 PDE10A (0.40) PDE10ADRD1MEN1KMT2AALDH1A1
SCHEMBL20406236 0.80 HTR1A (0.39) MAPT
SCHEMBL18661534 0.79 PDE10A (0.47) PDE10AMEN1KMT2AAHR
SCHEMBL20406612 0.79 PDE10A (0.48) PDE10ADRD1MEN1KMT2AALDH1A1

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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