SCHEMBL7258251

SCHEMBL7258251

C=CC(=O)Oc1ccc(-c2c3nc(c(-c4ccccc4)c4ccc([nH]4)c(-c4ccccc4)c4nc(c(-c5ccccc5)c5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 4/20 0.56
▸ CYCS P99999 4/20 0.54
▸ ABCG2 Q9UNQ0 1/20 0.47
▸ ENPP2 Q13822 1/20 0.47
▸ STAT3 P40763 1/20 0.43
▸ STAT1 P42224 1/20 0.43
▸ PDE6D O43924 1/20 0.42
▸ TERT O14746 4/20 0.41

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
SCHEMBL7262340 0.83 TOP1 (0.53) TOP1CYCSABCG2ENPP2STAT3
SCHEMBL13609840 0.82 TOP1 (0.56) TOP1CYCSABCG2ENPP2STAT3
SCHEMBL31019566 0.82 TOP1 (0.52) TOP1CYCSABCG2ENPP2STAT3
SCHEMBL2403632 0.79 TOP1 (0.54) TOP1CYCSABCG2ENPP2STAT3
SCHEMBL10523963 0.79 TOP1 (0.60) TOP1CYCSABCG2ENPP2TERT
SCHEMBL10730297 0.79 MEN1 (0.57) TOP1CYCSABCG2ENPP2
Acetic Acid SCHEMBL9639956 0.78 TOP1 (0.67) TOP1CYCSABCG2ENPP2STAT3
SCHEMBL30136 0.78 TOP1 (0.64) TOP1CYCSENPP2STAT3STAT1
SCHEMBL29405434 0.78 TOP1 (0.64) TOP1CYCSENPP2STAT3STAT1
SCHEMBL25395869 0.77 TOP1 (0.91) TOP1CYCSABCG2ENPP2STAT3

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
EP-0891977-B1 5-(4-Hydroxyphenyl)-porphyrin derivatives as photosensitisers DLR EV (DE) 2003-01-29 — — EP disclosed
US-6107480-A 5-(HYDROXYLATEDPHENYL) PORPHYRIN DERIVATIVES WHICH MAY BE COVALENTLY BONDED TO SPECIFIED POLYMERS VIA THE HYDROXYLATED PHENYL GROUP; USE AS PHOTOSENSITIZERS FOR THE CATALYTIC FORMATION OF SINGLET OXYGEN DLR, DEUTSCHE ZENTRUM FUR LUFT UND RAUMFAHRT E.V. (DE) 2000-08-22 — — US disclosed
EP-0891977-A1 5-(4-Hydroxyphenyl)-porphyrin derivatives as photosensitisers DLR Deutsches Zentrum für Luft- und Raumfahrt e.V. (DE) 1999-01-20 — — EP disclosed
WO-1993000815-A1 POLYMER COMPOSITIONS COURTAULDS PLC (GB) 1993-01-21 — — WO disclosed
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