SCHEMBL22945901

SCHEMBL22945901

Cc1ccc(C(O)COc2c(C(=O)c3ccc(Cl)c(CN4CCS(=O)(=O)CC4)c3Cl)c(C)nn2C)cc1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ABCB1 P08183 2/20 0.36
LMNA P02545 1/20 0.32
DHODH Q02127 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
SCHEMBL22945894 0.81 ABCB1 (0.38) MEN1KMT2AABCB1LMNA
SCHEMBL22945898 0.81 KMT2A (0.38) MEN1KMT2ADHODH
SCHEMBL22945897 0.79 HTR1D (0.35) KMT2A
SCHEMBL22945895 0.76 MEN1 (0.35) MEN1KMT2ALMNA
SCHEMBL22946180 0.75 HPGD (0.32) MEN1KMT2AABCB1LMNA
SCHEMBL23061054 0.73 ABCB1 (0.37) ABCB1
SCHEMBL22946182 0.70 ALDH1A1 (0.39) MEN1KMT2AABCB1LMNA
SCHEMBL22946175 0.70 ABCB1 (0.35) MEN1KMT2AABCB1LMNA
SCHEMBL22945899 0.69 KMT2A (0.37) MEN1KMT2ADHODH
SCHEMBL22946159 0.68 GAA (0.35) LMNA

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-2021018135-A1 HETEROCYCLYL ALKYL SUBSTITUTED DICHLOROBENZOYL COMPOUNDS AND APPLICATIONS THEREOF 东莞市东阳光农药研发有限公司 2021-02-04 WO disclosed