SCHEMBL10992447

SCHEMBL10992447

COc1ccc(-c2nc(S(=O)(=O)c3ccc(C)cc3)n(Cc3ccccc3)c2-c2ccc(OC)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 7/20 0.51
▸ HTT P42858 6/20 0.51
▸ KDM4E B2RXH2 4/20 0.51
▸ ALDH1A1 P00352 7/20 0.50
▸ NPSR1 Q6W5P4 6/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.50
▸ MAPT P10636 3/20 0.50
▸ HPGD P15428 3/20 0.50
▸ TP53 P04637 2/20 0.50
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ CNR2 P34972 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ PTBP1 P26599 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ MITF O75030 1/20 0.43

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
SCHEMBL10987849 0.78 HTT (0.50) LMNAHTTKDM4EALDH1A1NPSR1
SCHEMBL10992481 0.77 HTT (0.52) LMNAHTTKDM4EALDH1A1NPSR1
SCHEMBL6553811 0.74 CYP19A1 (0.47) LMNAHTTKDM4EALDH1A1NPSR1
SCHEMBL23063346 0.73 KDM4E (0.48) LMNAHTTKDM4EALDH1A1NPSR1
SCHEMBL10997238 0.72 ALDH1A1 (0.52) LMNAHTTKDM4EALDH1A1NPSR1
Trifluoroacetic Acid SCHEMBL8798382 0.71 ALDH1A1 (0.54) LMNAHTTKDM4EALDH1A1NPSR1
SCHEMBL10923602 0.71 ALDH1A1 (0.48) LMNAHTTKDM4EALDH1A1NPSR1
SCHEMBL8798390 0.71 ALDH1A1 (0.54) LMNAHTTKDM4EALDH1A1NPSR1
SCHEMBL9539501 0.70 NPSR1 (0.48) LMNAHTTKDM4EALDH1A1NPSR1
SCHEMBL7268077 0.69 CYP1A2 (0.54) LMNAALDH1A1TP53CYP2D6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4402960-A Antiinflammatory imidazole derivatives SCHERING AKTIENGESELLSCHAFT (DE) 1983-09-06 — — US claimed
US-4528298-A Antiinflammatory imidazole derivatives SCHERING AKTIENGESELLSCHAFT (DE) 1985-07-09 — — US disclosed
US-4402960-A Antiinflammatory imidazole derivatives SCHERING AKTIENGESELLSCHAFT (DE) 1983-09-06 — — US disclosed
EP-0043788-A1 Imidazole derivatives, process for their preparation and their pharmaceutical compositions SCHERING AKTIENGESELLSCHAFT (DE) 1982-01-13 — — EP disclosed
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