SCHEMBL29628931

SCHEMBL29628931

Cc1ccc(NC=O)cc1Nc1nccc(-c2cccnc2)n1

nearest known ligand 0.78

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PRKCA P17252 2/20 0.78
▸ ABL1 P00519 15/20 0.72
▸ BCR P11274 13/20 0.72
▸ PDGFRA P16234 9/20 0.72
▸ PDGFRB P09619 5/20 0.72
▸ EGFR P00533 2/20 0.70
▸ JAK3 P52333 1/20 0.70
▸ BTK Q06187 1/20 0.70
▸ ITK Q08881 1/20 0.70
▸ KIT P10721 3/20 0.61

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
SCHEMBL28349322 1.00 PRKCA (0.78) PRKCAABL1BCRPDGFRAPDGFRB
SCHEMBL15159937 0.88 PRKCA (1.00) PRKCAABL1BCRPDGFRAPDGFRB
SCHEMBL18814452 0.87 PRKCA (0.81) PRKCAABL1BCRPDGFRAPDGFRB
SCHEMBL23246300 0.85 ABL1 (0.86) PRKCAABL1BCRPDGFRAPDGFRB
SCHEMBL22793720 0.85 PRKCA (0.78) PRKCAABL1BCRPDGFRAPDGFRB
SCHEMBL1566169 0.84 ABL1 (0.72) PRKCAABL1BCRPDGFRAPDGFRB
SCHEMBL12320924 0.84 ABL1 (0.78) PRKCAABL1BCRPDGFRAPDGFRB
SCHEMBL19556857 0.84 ABL1 (1.00) PRKCAABL1BCRPDGFRAPDGFRB
SCHEMBL2229310 0.83 EGFR (1.00) PRKCAABL1BCRPDGFRAPDGFRB
SCHEMBL28434538 0.82 PRKCA (0.53) PRKCAABL1BCRPDGFRAPDGFRB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114656451-A Benzamide derivative, preparation method and application 海南医学院 2022-06-24 — — CN claimed
CN-114656451-A Benzamide derivative, preparation method and application 海南医学院 2022-06-24 — — CN disclosed
CN-114656451-A Benzamide derivative, preparation method and application 海南医学院 2022-06-24 — — CN disclosed
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