SCHEMBL11521860

SCHEMBL11521860

CCCOc1ccc(OS(=O)(=O)c2ccc(NC(C)=O)c(N)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.51
▸ LMNA P02545 3/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ CA1 P00915 5/20 0.46
▸ CA2 P00918 5/20 0.46
▸ CA9 Q16790 5/20 0.46
▸ CA12 O43570 3/20 0.46
▸ CA7 P43166 2/20 0.46
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ ALDH1A1 P00352 7/20 0.43
▸ MAPT P10636 3/20 0.43
▸ RECQL P46063 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ HSP90AA1 P07900 1/20 0.42
▸ MMP1 P03956 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40

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
SCHEMBL11522502 0.95 LMNA (0.52) NPC1LMNASMN1; SMN2CA1CA2
SCHEMBL11518670 0.91 NPC1 (0.53) NPC1LMNASMN1; SMN2CA1CA2
SCHEMBL11520762 0.85 NPC1 (0.50) NPC1LMNASMN1; SMN2CA1CA2
SCHEMBL11519378 0.84 NPC1 (0.56) NPC1LMNASMN1; SMN2CA1CA2
SCHEMBL11522923 0.84 NPC1 (0.56) NPC1LMNASMN1; SMN2CA1CA2
SCHEMBL11519502 0.83 NPC1 (0.55) NPC1LMNASMN1; SMN2CA1CA2
SCHEMBL11518189 0.83 KMT2A (0.64) NPC1LMNASMN1; SMN2CA1CA2
SCHEMBL11521258 0.83 NPC1 (0.58) NPC1LMNASMN1; SMN2CA1CA2
SCHEMBL11520065 0.83 NPC1 (0.52) NPC1LMNASMN1; SMN2CA1CA2
SCHEMBL11458885 0.81 CA1 (0.56) LMNASMN1; SMN2CA1CA2CA9

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
US-4176192-A ANTHELMINTICS HOECHST AKTIENGESELLSCHAFT (DE) 1979-11-27 — — US disclosed
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