SCHEMBL30107577

SCHEMBL30107577

CC(C)(C)OC(=O)N1CCc2c(OB(O)O)cncc21

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ UCHL1 P09936 6/20 0.38
▸ CYP11B2 P19099 1/20 0.36
▸ USP30 Q70CQ3 1/20 0.35
▸ KDM1A O60341 1/20 0.35
▸ CHRM4 P08173 1/20 0.35
▸ DRD2 P14416 1/20 0.35
▸ HTR7 P34969 1/20 0.35
▸ GPR119 Q8TDV5 6/20 0.34
▸ NOTUM Q6P988 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ MPO P05164 1/20 0.32

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
SCHEMBL20519360 0.86 UCHL1 (0.40) UCHL1CYP11B2USP30KDM1ACHRM4
SCHEMBL30913149 0.82 UCHL1 (0.48) UCHL1CYP11B2USP30KDM1ACHRM4
SCHEMBL28812323 0.82 UCHL1 (0.48) UCHL1CYP11B2USP30KDM1ACHRM4
SCHEMBL30955311 0.80 UCHL1 (0.39) UCHL1CYP11B2USP30KDM1ACHRM4
SCHEMBL20517386 0.79 GPR119 (0.38) UCHL1CYP11B2USP30KDM1ACHRM4
SCHEMBL30955229 0.75 ADORA1 (0.42) UCHL1USP30GPR119HDAC1HDAC6
SCHEMBL25150812 0.74 UCHL1 (0.44) UCHL1CYP11B2USP30KDM1AGPR119
SCHEMBL28812299 0.73 USP30 (0.39) UCHL1CYP11B2USP30KDM1AGPR119
SCHEMBL29435672 0.71 CHRM4 (0.43) CYP11B2KDM1ACHRM4DRD2HTR7
SCHEMBL649859 0.71 CHRM4 (0.43) CYP11B2KDM1ACHRM4DRD2HTR7

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
CN-110678466-B Diazanaphthalenes as HPK1 inhibitors 豪夫迈·罗氏有限公司 2023-01-31 — — CN disclosed
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