SCHEMBL17916737

SCHEMBL17916737

C[C@H]1CC(Nc2cnn(C)c(=O)c2Cl)CN(C)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ KAT2B Q92831 20/20 1.00
▸ KAT2A Q92830 1/20 0.71
▸ BRD9 Q9H8M2 1/20 0.68
▸ BPTF Q12830 1/20 0.67

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
SCHEMBL17916735 1.00 KAT2B (1.00) KAT2BKAT2ABRD9BPTF
SCHEMBL17916734 1.00 KAT2B (1.00) KAT2BKAT2ABRD9BPTF
SCHEMBL17916730 1.00 KAT2B (1.00) KAT2BKAT2ABRD9BPTF
SCHEMBL17916739 1.00 KAT2B (1.00) KAT2BKAT2ABRD9BPTF
SCHEMBL20841479 1.00 KAT2B (1.00) KAT2BKAT2ABRD9BPTF
SCHEMBL17916732 0.83 KAT2B (1.00) KAT2BKAT2ABRD9BPTF
SCHEMBL17916726 0.83 KAT2B (1.00) KAT2BKAT2ABRD9BPTF
SCHEMBL17916724 0.83 KAT2B (1.00) KAT2BKAT2ABRD9BPTF
SCHEMBL17916629 0.82 KAT2B (1.00) KAT2BBPTF
SCHEMBL23682875 0.81 KAT2B (1.00) KAT2BKAT2ABRD9BPTF

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
WO-2016112298-A1 PYRIDAZINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CANCER GENENTECH, INC. (US) 2016-07-14 — — WO disclosed
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