SCHEMBL11588296

SCHEMBL11588296

CCCCSc1cccc2c1C(=O)NC2=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SOAT1 P35610 10/20 0.42
▸ PTGS2 P35354 4/20 0.42
▸ S100A4 P26447 1/20 0.42
▸ KDM4E B2RXH2 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ P4HB P07237 1/20 0.39
▸ TSHR P16473 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ GSK3B P49841 1/20 0.37
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ PARP1 P09874 1/20 0.36

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
SCHEMBL7747518 0.94 SOAT1 (0.45) SOAT1PTGS2KDM4EALDH1A1GAA
SCHEMBL2426921 0.94 SOAT1 (0.45) SOAT1PTGS2KDM4EALDH1A1GAA
SCHEMBL10335607 0.91 ALDH1A1 (0.42) SOAT1PTGS2KDM4EALDH1A1GAA
Formamide SCHEMBL28145518 0.88 SOAT1 (0.40) SOAT1PTGS2KDM4EALDH1A1GAA
SCHEMBL21111964 0.84 KDM4E (0.44) SOAT1S100A4KDM4EALDH1A1GAA
SCHEMBL30609814 0.81 KDM4E (0.45) S100A4KDM4EALDH1A1GAAHPGD
SCHEMBL11604127 0.81 GSK3B (0.39) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL9017718 0.80 SOAT1 (0.49) SOAT1PTGS2S100A4KDM4EP4HB
SCHEMBL2359302 0.78 GSK3B (0.42) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL10581743 0.77 SOAT1 (0.54) SOAT1PTGS2S100A4KDM4EALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4068071-A DISULFIDING, SOLVOLYSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) 1978-01-10 — — US claimed
CN-108350018-A The manufacturing method of oligonucleotides 日产化学工业株式会社 2018-07-31 — — CN disclosed
US-4068071-A DISULFIDING, SOLVOLYSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) 1978-01-10 — — US disclosed
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