SCHEMBL30424829

SCHEMBL30424829

CC(C)(C)OC(=O)NCc1nn(-c2ccc(S(F)(F)(F)(F)F)cc2)c2cccc(Br)c12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 4/20 0.36
▸ CA12 O43570 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ HDAC10 Q969S8 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35
▸ SCN9A Q15858 1/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ CCNC P24863 1/20 0.34
▸ CDK8 P49336 1/20 0.34
▸ GFER P55789 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ CYP2D6 P10635 2/20 0.34
▸ NAMPT P43490 2/20 0.33
▸ GLS O94925 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ PARP1 P09874 1/20 0.33

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
SCHEMBL25203706 1.00 BRD4 (0.36) BRD4CA12CA1CA2CA9
SCHEMBL25202803 0.87 NSD2 (0.37) BRD4CA12CA1CA2CA9
SCHEMBL30424251 0.87 NSD2 (0.37) BRD4CA12CA1CA2CA9
SCHEMBL30424238 0.85 TEAD1 (0.42) BRD4HDAC10HDAC6SCN9AL3MBTL1
SCHEMBL25243401 0.85 TEAD1 (0.42) BRD4HDAC10HDAC6SCN9AL3MBTL1
SCHEMBL25249750 0.85 P2RX7 (0.34) HDAC6SCN9ACYP2D6POLBCYP1A2
SCHEMBL25751802 0.79 TEAD1 (0.43) BRD4CA12CA1CA2CA9
SCHEMBL25751810 0.78 TEAD1 (0.55) BRD4CA12CA1CA2CA9
SCHEMBL25751808 0.77 TEAD1 (0.41) BRD4CA12CA1CA2CA9
SCHEMBL25751804 0.76 TEAD1 (0.41) BRD4CA12CA1CA2CA9

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-118302411-A Therapeutic indazole compounds and methods of use thereof for the treatment of cancer 基因泰克公司 2024-07-05 — — CN disclosed
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