SCHEMBL14285084

SCHEMBL14285084

Oc1cccc(-c2c3cc(c(-c4cccc(O)c4)c4ccc([nH]4)c(-c4cccc(O)c4)c4nc(c(-c5cccc(O)c5)c5ccc2[nH]5)C=C4)N=C3)c1

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 2/20 0.39
▸ TERT O14746 3/20 0.39
▸ CYCS P99999 3/20 0.39
▸ ENPP2 Q13822 1/20 0.38
▸ STAT3 P40763 1/20 0.37
▸ STAT1 P42224 1/20 0.37
▸ RIPK1 Q13546 1/20 0.35
▸ MAPK13 O15264 1/20 0.35
▸ RAF1 P04049 1/20 0.35
▸ BRAF P15056 1/20 0.35
▸ MAPK12 P53778 1/20 0.35
▸ MAPK11 Q15759 1/20 0.35
▸ MAPK14 Q16539 1/20 0.35
▸ BRDT Q58F21 1/20 0.35

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
SCHEMBL14285065 0.86 STAT3 (0.50) TOP1TERTCYCSENPP2STAT3
SCHEMBL249199 0.85 TOP1 (0.50) TOP1TERTCYCSENPP2STAT3
SCHEMBL29556430 0.85 TOP1 (0.50) TOP1TERTCYCSENPP2STAT3
SCHEMBL31296593 0.85 TOP1 (0.50) TOP1TERTCYCSENPP2STAT3
SCHEMBL30297908 0.84 TERT (0.51) TOP1TERTCYCSENPP2STAT3
SCHEMBL29648445 0.84 TERT (0.51) TOP1TERTCYCSENPP2STAT3
SCHEMBL8865323 0.84 TERT (0.51) TOP1TERTCYCSENPP2STAT3
SCHEMBL13907391 0.83 STAT3 (0.50) TOP1TERTCYCSENPP2STAT3
SCHEMBL14285083 0.82 NR1I2 (0.40) TOP1TERTMAPK13RAF1MAPK12
SCHEMBL1640992 0.82 TOP1 (0.54) TOP1TERTCYCSENPP2STAT3

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-7319147-B2 Porphyrins and related compounds BIOSCIENCE TECHNOLOGY INVESTMENT HOLDINGS LIMITED (MY) 2008-01-15 — — US disclosed
US-7319147-B2 Porphyrins and related compounds BIOSCIENCE TECHNOLOGY INVESTMENT HOLDINGS LIMITED (MY) 2008-01-15 — — US disclosed
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