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SCHEMBL16433683

SCHEMBL16433683

Cc1cc(-c2c3nc(c(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4ccc([nH]4)c(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4nc(c(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)c5ccc2[nH]5)C=C4)C=C3)cc(C(C)(C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 6/20 0.46
▸ TOP1 P11387 4/20 0.41
▸ CYCS P99999 3/20 0.40
▸ ABCG2 Q9UNQ0 1/20 0.40
▸ ENPP2 Q13822 1/20 0.40
▸ RXRA P19793 1/20 0.38
▸ RXRB P28702 1/20 0.38

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
SCHEMBL2064907 0.93 TERT (0.51) TERTTOP1CYCSABCG2ENPP2
SCHEMBL28670658 0.86 STAT3 (0.51) TERTTOP1CYCSABCG2ENPP2
SCHEMBL3476670 0.85 TERT (0.56) TERTTOP1CYCSABCG2ENPP2
SCHEMBL31612941 0.85 TERT (0.56) TERTTOP1CYCSABCG2ENPP2
SCHEMBL28665111 0.84 STAT3 (0.50) TERTTOP1CYCSABCG2ENPP2
SCHEMBL30831251 0.84 TERT (0.44) TERTTOP1CYCSABCG2ENPP2
SCHEMBL5013770 0.84 TERT (0.44) TERTTOP1CYCSABCG2ENPP2
SCHEMBL16604345 0.83 STAT3 (0.49) TERTTOP1CYCSABCG2ENPP2
SCHEMBL17232405 0.82 TERT (0.43) TERTTOP1CYCSABCG2ENPP2
SCHEMBL6505248 0.81 STAT3 (0.48) TERTTOP1CYCSABCG2ENPP2

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-8945513-B2 Star polymer nanoshells and methods of preparation thereof INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2015-02-03 — — US disclosed
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