SCHEMBL13679705

SCHEMBL13679705

CCOC/C=C/c1ccc(-c2nc(-c3ccc(NC(C)C)cc3)c[nH]2)cc1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 1/20 0.67
▸ SREBF2 Q12772 1/20 0.32

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
SCHEMBL13679748 0.88 ABCB1 (0.52) ABCB1
SCHEMBL13679752 0.85 ABCB1 (0.48) ABCB1
SCHEMBL3827085 0.82 ABCB1 (0.44) ABCB1
SCHEMBL3827087 0.82 ABCB1 (0.44) ABCB1
SCHEMBL13679681 0.81 ABCB1 (0.43) ABCB1
SCHEMBL3826448 0.80 ABCB1 (1.00) ABCB1
SCHEMBL719050 0.80 ABCB1 (1.00) ABCB1
SCHEMBL13679704 0.79 ABCB1 (0.42) ABCB1
SCHEMBL3830858 0.77 ABCB1 (0.92) ABCB1
SCHEMBL13679699 0.77 ABCB1 (0.92) ABCB1

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
EP-0999835-B1 IMIDAZOLE DERIVATIVES AS MDR MODULATORS TAIJI BIOMEDICAL INC (US) 2009-09-09 — — EP disclosed
EP-2082740-A2 Use of imidazole derivatives as MDR modulators Taiji Biomedical, Inc. (US) 2009-07-29 — — EP disclosed
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