SCHEMBL11490146

SCHEMBL11490146

NC(O)=S.O=C(CCCN(Cc1ccc(Cl)cc1)C(O)=S)NCCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ USP2 O75604 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ MEN1 O00255 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ PLAAT3 P53816 2/20 0.48
▸ PLAAT5 Q96KN8 2/20 0.48
▸ PLAAT2 Q9NWW9 2/20 0.48
▸ PLAAT4 Q9UL19 2/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ TRPV1 Q8NER1 1/20 0.48
▸ HDAC3 O15379 2/20 0.48
▸ HDAC1 Q13547 2/20 0.48
▸ HDAC2 Q92769 2/20 0.48
▸ HDAC10 Q969S8 2/20 0.48
▸ HDAC11 Q96DB2 2/20 0.48
▸ HDAC8 Q9BY41 2/20 0.48
▸ HDAC6 Q9UBN7 2/20 0.48

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
SCHEMBL11490144 0.88 HTT (0.56) HTTNPSR1L3MBTL1USP2HPGD
SCHEMBL11495362 0.83 HTT (0.49) HTTNPSR1L3MBTL1USP2HPGD
SCHEMBL11490047 0.81 SIGMAR1 (0.42) HTTMEN1KMT2ASMN1; SMN2HDAC3
SCHEMBL11490100 0.76 POLB (0.53) NPSR1HPGDMEN1KMT2AHDAC3
SCHEMBL11494201 0.75 CNR2 (0.46) HTTHPGDMEN1KMT2ASMN1; SMN2
SCHEMBL15845229 0.74 GAA (0.60) L3MBTL1HPGDTRPV1HDAC3HDAC1
SCHEMBL13073412 0.73 HDAC3 (0.78) L3MBTL1HPGDMEN1KMT2APLAAT3
SCHEMBL207794 0.72 SMN1; SMN2 (0.70) HTTUSP2HPGDMEN1KMT2A
SCHEMBL19334423 0.72 TSHR (0.67) HTTUSP2HPGDMEN1KMT2A
SCHEMBL10436247 0.72 HDAC3 (0.74) L3MBTL1MEN1KMT2APLAAT3PLAAT5

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-4202832-A ANTILIPEMIC AGENTS HOFFMANN-LA ROCHE INC. (US) 1980-05-13 — — US disclosed
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