SCHEMBL11286933

SCHEMBL11286933

Cc1ccc(C)c(C(=O)N=C=O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ TSHR P16473 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ CSNK2A1 P68400 1/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HSD17B10 Q99714 2/20 0.37
▸ HDAC3 O15379 1/20 0.37
▸ HDAC4 P56524 1/20 0.37
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC7 Q8WUI4 1/20 0.37
▸ HDAC2 Q92769 1/20 0.37
▸ HDAC10 Q969S8 1/20 0.37
▸ HDAC11 Q96DB2 1/20 0.37
▸ HDAC8 Q9BY41 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37
▸ HDAC9 Q9UKV0 1/20 0.37

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
SCHEMBL5824889 0.84 MEN1 (0.45) MEN1KMT2ATSHRGAACSNK2A1
SCHEMBL16590409 0.82 CPS1 (0.39) MEN1KMT2ATSHRCSNK2A1SMN1; SMN2
SCHEMBL4936719 0.77 ERCC5 (0.46) KMT2ATSHRSMN1; SMN2NPC1HPGD
SCHEMBL30341583 0.76 MEN1 (0.47) MEN1KMT2ATSHRGAACSNK2A1
SCHEMBL11912035 0.76 MEN1 (0.47) MEN1KMT2ATSHRGAACSNK2A1
SCHEMBL9862051 0.73 MEN1 (0.57) MEN1KMT2ATSHRGAACSNK2A1
SCHEMBL9420245 0.73 MEN1 (0.57) MEN1KMT2ATSHRGAACSNK2A1
Hydrochloric Acid SCHEMBL8393812 0.73 SLC9A1 (0.53) CYP2D6
SCHEMBL811028 0.72 ALDH1A1 (0.50) MEN1KMT2AGAASMN1; SMN2NPC1
SCHEMBL27601016 0.71 MEN1 (0.40) MEN1KMT2ATSHRGAACSNK2A1

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
EP-0047496-A1 Sulfonyl ureas, processes for their production, pharmaceutical compositions based on these compounds and their use HOECHST AKTIENGESELLSCHAFT (DE) 1982-03-17 — — EP disclosed
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