SCHEMBL25565834

SCHEMBL25565834

CC(C)c1ccc(-n2ccc(=O)[nH]c2=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 3/20 0.59
DDB1 Q16531 1/20 0.59
MGLL Q99685 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
RECQL P46063 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALKBH5 Q6P6C2 1/20 0.39
NOTUM Q6P988 1/20 0.39
PKM P14618 1/20 0.38
TYR P14679 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL15341777 0.81 CRBN (0.59) CRBNDDB1TDP1NOTUMPKM
SCHEMBL1380327 0.79 CRBN (0.66) CRBNDDB1LMNAPKMALDH1A1
SCHEMBL5325743 0.79 CRBN (0.66) CRBNDDB1MGLLPKMKDM4E
SCHEMBL8721189 0.79 MGLL (0.46) CRBNDDB1MGLLTDP1KMT2A
SCHEMBL18640431 0.77 CRBN (0.53) CRBNDDB1LMNAPOLBPKM
SCHEMBL23120610 0.76 CRBN (0.66) CRBNDDB1MGLLKMT2ALMNA
SCHEMBL21995599 0.76 CRBN (0.66) CRBNDDB1MGLLKMT2APOLB
SCHEMBL25207533 0.76 CRBN (0.66) CRBNDDB1MGLLTDP1KMT2A
SCHEMBL28744560 0.75 CRBN (0.59) CRBNDDB1MGLLKMT2AMEN1
SCHEMBL23345977 0.75 CRBN (0.59) CRBNDDB1KMT2AMEN1PKM

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-2023096995-A1 COMPOSITIONS AND METHODS COMPRISING SUBSTITUTED N-(2-CHLORO-6-METHYLPHENYL)-2-((6-(6-MEMBERED HETEROCYCLOALKYL)-2-METHYLPYRIMIDIN-4-YL)AMINO)THIAZOLE-5-CARBOXAMIDE ANALOGUES ST. JUDE CHILDREN'S RESEARCH HOSPITAL, INC. (US) 2023-06-01 WO disclosed