SCHEMBL26932253

SCHEMBL26932253

CC(C)(C)OC(=O)NCc1ccc(I)cc1Br

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4A O75164 1/20 0.43
▸ KCNA5 P22460 1/20 0.40
▸ RIPK1 Q13546 1/20 0.39
▸ HDAC10 Q969S8 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ IDO1 P14902 2/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ NQO2 P16083 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ CA1 P00915 5/20 0.37
▸ CA12 O43570 4/20 0.37
▸ CTSS P25774 1/20 0.37
▸ CTSK P43235 1/20 0.37
▸ CA7 P43166 1/20 0.37
▸ CA14 Q9ULX7 1/20 0.37
▸ CA2 P00918 4/20 0.37
▸ CA9 Q16790 3/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ HTT P42858 1/20 0.36

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
SCHEMBL18521895 0.89 KDM4A (0.43) KDM4AKCNA5RIPK1HDAC10HDAC6
SCHEMBL23105674 0.83 P2RX7 (0.48) KDM4AKCNA5RIPK1HDAC10HDAC6
SCHEMBL16971616 0.83 IDO1 (0.51) KDM4AKCNA5HDAC10HDAC6IDO1
SCHEMBL2446141 0.82 EPHX2 (0.46) KDM4AKCNA5RIPK1HDAC10HDAC6
SCHEMBL6950153 0.82 HDAC10 (0.43) KDM4AKCNA5RIPK1HDAC10HDAC6
SCHEMBL31704494 0.81 CACNA1H (0.46) KDM4AKCNA5RIPK1HDAC10HDAC6
SCHEMBL2441663 0.81 NOTUM (0.48) KDM4AKCNA5RIPK1HDAC10HDAC6
SCHEMBL30101811 0.81 KDM4A (0.43) KDM4AKCNA5HDAC10HDAC6IDO1
SCHEMBL30101874 0.81 KDM4A (0.43) KDM4AKCNA5RIPK1IDO1HDAC1
SCHEMBL1329466 0.80 RIPK1 (0.60) KDM4AKCNA5RIPK1HDAC10HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023239645-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-12-14 — — WO disclosed
WO-2023239645-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-12-14 — — WO disclosed
Send feedback