SCHEMBL5706544

SCHEMBL5706544

Oc1cccc(C2=C3C=CC(=N3)C(c3cccc(O)c3O)=C3C=CC(=N3)C(c3cccc(O)c3O)=C3C=CC(=N3)C(c3cccc(O)c3O)=C3C=CC2=N3)c1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 5/20 0.39
▸ ALOX15 P16050 5/20 0.39
▸ HSD17B10 Q99714 5/20 0.39
▸ ALDH1A1 P00352 4/20 0.39
▸ TDP1 Q9NUW8 4/20 0.39
▸ RECQL P46063 3/20 0.39
▸ LMNA P02545 3/20 0.39
▸ ADAMTS4 O75173 1/20 0.39
▸ EGFR P00533 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ FYN P06241 1/20 0.39
▸ MMP2 P08253 1/20 0.39
▸ MMP9 P14780 1/20 0.39
▸ MMP8 P22894 1/20 0.39
▸ CA6 P23280 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ MMP12 P39900 1/20 0.39
▸ ADAMTS5 Q9UNA0 1/20 0.39
▸ ESR1 P03372 2/20 0.36

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
SCHEMBL498541 0.85 ALDH1A1 (0.40) HPGDALOX15HSD17B10ALDH1A1TDP1
SCHEMBL9404581 0.77 HPGD (0.47) HPGDALOX15HSD17B10ALDH1A1TDP1
SCHEMBL9559685 0.71 MEN1 (0.30) MEN1KMT2A
SCHEMBL5013871 0.70 KDM4E (0.38) HPGDALOX15HSD17B10ALDH1A1TDP1
SCHEMBL5015297 0.70 KDM4E (0.38) HPGDALOX15HSD17B10ALDH1A1TDP1
SCHEMBL29453072 0.70 ALDH1A1 (0.69) HPGDALOX15HSD17B10ALDH1A1TDP1
SCHEMBL337585 0.70 ALDH1A1 (0.69) HPGDALOX15HSD17B10ALDH1A1TDP1
SCHEMBL3118129 0.69 ALDH1A1 (0.46) HPGDALOX15HSD17B10ALDH1A1TDP1
SCHEMBL5918765 0.69 IDO1 (0.35) IDO1
SCHEMBL8681981 0.68 ALDH1A1 (0.58) HPGDALOX15HSD17B10ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1699844-A1 HYPERBRANCHED POLYMERS THE UNIVERSITY OF SHEFFIELD (GB) 2006-09-13 — — EP disclosed
WO-2005052023-A1 HYPERBRANCHED POLYMERS THE UNIVERSITY OF SHEFFIELD (GB) 2005-06-09 — — WO disclosed
US-20050113554-A1 Hyperbranched polymers UNIVERSITY OF SHEFFIELD, THE (GB) 2005-05-26 — — US disclosed
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