SCHEMBL24344233

SCHEMBL24344233

COc1nc(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)nc(OC)c1C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 1/20 0.32
KCNQ2 O43526 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
SCHEMBL24343977 0.85 KCNQ3 (0.32) KCNQ3KCNQ2
SCHEMBL24344820 0.85 PAX8 (0.35) KCNQ3KCNQ2
SCHEMBL26978141 0.85 ALDH1A1 (0.36) KCNQ3KCNQ2
SCHEMBL26978305 0.81 HDAC6 (0.30)
SCHEMBL27035943 0.78 ALDH1A1 (0.33)
SCHEMBL24330513 0.78 SYK (0.31)
SCHEMBL25367316 0.77 ATR (0.34) KCNQ3KCNQ2
SCHEMBL24344231 0.77 CYP1A2 (0.41)
SCHEMBL26980538 0.76 GAA (0.38)
SCHEMBL29903731 0.76 TDP1 (0.33)

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-2022076975-A1 5- AND 6-AZAINDOLE COMPOUNDS FOR INHIBITION OF BCR-ABL TYROSINE KINASES ENLIVEN THERAPEUTICS, INC. (US) 2022-04-14 WO disclosed