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SCHEMBL1667744

SCHEMBL1667744

Cc1csc(C)c1-c1c(C(N)=NO)c2cccnc2n1-c1ccc(O)cc1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ USP14 P54578 1/20 0.33
▸ NTRK1 P04629 3/20 0.32
▸ PIM1 P11309 3/20 0.32
▸ CHEK1 O14757 2/20 0.32
▸ CDK2 P24941 2/20 0.32
▸ CSNK2A1 P68400 2/20 0.32
▸ HSP90AA1 P07900 1/20 0.32
▸ HSP90AB1 P08238 1/20 0.32
▸ REN P00797 1/20 0.30

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
SCHEMBL1667743 1.00 USP14 (0.33) USP14NTRK1PIM1CHEK1CDK2
SCHEMBL1667668 0.88 HSP90AA1 (0.39) USP14HSP90AA1HSP90AB1REN
SCHEMBL1667747 0.82 USP14 (0.33) USP14REN
SCHEMBL1667700 0.80 BRD4 (0.36) USP14NTRK1PIM1CHEK1CDK2
SCHEMBL1667699 0.80 BRD4 (0.36) USP14NTRK1PIM1CHEK1CDK2
SCHEMBL1667882 0.80 NTRK1 (0.33) USP14NTRK1PIM1CHEK1CDK2
SCHEMBL1667883 0.80 NTRK1 (0.33) USP14NTRK1PIM1CHEK1CDK2
SCHEMBL1668166 0.79 USP14 (0.33) USP14NTRK1PIM1CHEK1CDK2
SCHEMBL1668164 0.79 USP14 (0.33) USP14NTRK1PIM1CHEK1CDK2
SCHEMBL1670133 0.79 CHEK1 (0.32) USP14NTRK1PIM1CHEK1CDK2

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-2011042474-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2011-04-14 — — WO claimed