SCHEMBL11844401

SCHEMBL11844401

CCOC(=O)C(Cl)c1ccc(-c2ccccc2SC)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIA2 P42262 1/20 0.39
▸ GRIA4 P48058 1/20 0.39
▸ ALDH1A1 P00352 4/20 0.39
▸ NPSR1 Q6W5P4 3/20 0.39
▸ LMNA P02545 3/20 0.39
▸ TSHR P16473 1/20 0.39
▸ PTPN1 P18031 1/20 0.36
▸ MMP8 P22894 1/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ NPC1 O15118 3/20 0.36
▸ MAPT P10636 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ TP53 P04637 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ MPI P34949 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
SCHEMBL11843915 0.85 GRIA2 (0.42) GRIA2GRIA4ALDH1A1NPSR1LMNA
SCHEMBL11837622 0.83 PPARG (0.45) GRIA2GRIA4ALDH1A1NPSR1LMNA
SCHEMBL11836185 0.82 GRM6 (0.42) GRIA2GRIA4ALDH1A1NPSR1MMP8
SCHEMBL11844271 0.82 MMP8 (0.38) ALDH1A1NPSR1LMNATSHRPTPN1
SCHEMBL11841890 0.82 ALDH1A1 (0.41) ALDH1A1NPSR1LMNATSHRMMP8
SCHEMBL11843289 0.82 GRIA2 (0.40) GRIA2GRIA4ALDH1A1NPSR1LMNA
SCHEMBL11839973 0.81 MMP8 (0.40) ALDH1A1NPSR1LMNATSHRPTPN1
SCHEMBL11836053 0.81 ALDH1A1 (0.44) ALDH1A1NPSR1LMNAMMP8SMN1; SMN2
SCHEMBL11846829 0.81 MEN1 (0.38) ALDH1A1NPSR1LMNATSHRPTPN1
SCHEMBL11849305 0.81 GRIA4 (0.46) GRIA4ALDH1A1NPSR1LMNATSHR

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-3941821-A ANTIINFLAMMATORY, ANALGESICS, ANTIPYRETICS WILLIAM H. RORER, INC. (US) 1976-03-02 — — US disclosed
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