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Sugi Predict / Compounds / SCHEMBL7785255

SCHEMBL7785255

SCHEMBL7785255

CC(C)Oc1ccc(C(NC(C)c2cc(F)cc(F)c2)c2cccc(Nc3c(OC(C)(C)C)c(=O)c3=O)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAPKAPK2 P49137 9/20 0.35
▸ MAPK14 Q16539 1/20 0.32
▸ POLB P06746 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ PPARA Q07869 1/20 0.30

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
SCHEMBL7787853 0.92 KMT2A (0.38) MAPKAPK2MAPK14POLBMEN1KMT2A
SCHEMBL7784926 0.92 KMT2A (0.38) MAPKAPK2MAPK14POLBMEN1KMT2A
SCHEMBL7780520 0.92 MAPKAPK2 (0.38) MAPKAPK2MAPK14POLBMEN1KMT2A
SCHEMBL7780422 0.91 MAPKAPK2 (0.41) MAPKAPK2MAPK14
SCHEMBL7785641 0.90 MAPKAPK2 (0.36) MAPKAPK2MAPK14POLBMEN1KMT2A
SCHEMBL7780562 0.90 POLB (0.39) MAPKAPK2MAPK14POLBMEN1KMT2A
SCHEMBL7780413 0.89 MAPKAPK2 (0.35) MAPKAPK2MAPK14POLBMEN1KMT2A
SCHEMBL7785106 0.89 MAPKAPK2 (0.35) MAPKAPK2MAPK14POLBMEN1KMT2A
SCHEMBL7787474 0.88 MAPKAPK2 (0.36) MAPKAPK2MAPK14POLB
SCHEMBL7784925 0.87 ALDH1A1 (0.41) MAPKAPK2MAPK14POLBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6329405-B1 AS ILEAL BILE ACID TRANSPORTER INHIBITOR, FOR THERAPY OF HYPERLIPEMIA SANKYO COMPANY, LIMITED (JP) 2001-12-11 — — US disclosed
EP-1070703-A1 Cyclobutene derivatives Sankyo Company Limited (JP) 2001-01-24 — — EP disclosed