SCHEMBL20406294

SCHEMBL20406294

Nc1ncc(Oc2ncccc2Br)cn1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FEN1 P39748 1/20 0.42
▸ PDE10A Q9Y233 6/20 0.41
▸ DRD1 P21728 1/20 0.38
▸ HSP90AA1 P07900 1/20 0.37
▸ GCK P35557 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ MEN1 O00255 2/20 0.34
▸ APAF1 O14727 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ TDP2 O95551 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ CASP3 P42574 1/20 0.34
▸ SENP8 Q96LD8 1/20 0.34
▸ SENP7 Q9BQF6 1/20 0.34
▸ SENP6 Q9GZR1 1/20 0.34

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
SCHEMBL20406087 0.83 MPO (0.43) FEN1PDE10ADRD1GCKRAB9A
SCHEMBL20406079 0.83 PDE10A (0.44) PDE10ADRD1GCKRAB9AMEN1
SCHEMBL580112 0.81 MEN1 (0.56) PDE10ADRD1GCKALDH1A1RAB9A
SCHEMBL20406280 0.80 PDE10A (0.40) PDE10ADRD1ALDH1A1RAB9AMEN1
SCHEMBL20406071 0.79 PDE10A (0.44) PDE10ADRD1GCKRAB9AMEN1
SCHEMBL3878940 0.79 PDE10A (0.43) PDE10ADRD1HSP90AA1GCKALDH1A1
SCHEMBL4008329 0.78 PDE10A (0.51) PDE10ADRD1ALDH1A1MEN1KMT2A
SCHEMBL15923259 0.77 LMNA (0.52) FEN1PDE10AALDH1A1MAPT
SCHEMBL20406088 0.77 PDE10A (0.42) PDE10ADRD1GCKRAB9A
SCHEMBL20406324 0.76 PDE10A (0.38) PDE10ADRD1GCKALDH1A1MAPT

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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