SCHEMBL19390810

SCHEMBL19390810

Cc1ccc(-c2c(C)ncnc2C#N)c(C)c1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ DRD1 P21728 13/20 0.51
▸ HSP90AB1 P08238 3/20 0.45
▸ USP8 P40818 1/20 0.40
▸ USP7 Q93009 1/20 0.40
▸ ERBB2 P04626 1/20 0.37
▸ EGLN2 Q96KS0 1/20 0.33
▸ GAA P10253 1/20 0.33

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
SCHEMBL17200288 0.85 DRD1 (0.49) DRD1USP7
SCHEMBL19390819 0.83 DRD1 (0.46) DRD1HSP90AB1GAA
SCHEMBL15698836 0.82 DRD1 (0.58) DRD1USP8
SCHEMBL19479326 0.81 DRD1 (0.57) DRD1USP8
SCHEMBL20171985 0.79 HSP90AB1 (0.43) DRD1HSP90AB1USP8USP7EGLN2
SCHEMBL15705497 0.79 DRD1 (0.55) DRD1
SCHEMBL15666826 0.74 DRD1 (0.51) DRD1USP7
SCHEMBL15696157 0.72 DRD1 (0.60) DRD1USP8USP7
SCHEMBL19479286 0.71 DRD1 (0.59) DRD1USP8USP7EGLN2
SCHEMBL29770983 0.70 ALOX15 (0.45) DRD1USP8

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-2917219-B1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS PFIZER (US) 2017-09-27 — — EP disclosed
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