SCHEMBL6265537

SCHEMBL6265537

CCCCCCCCCCCCCCCC(=O)Oc1cc2oc(=O)cc(C)c2cc1OC(=O)CCCCCCCCCCCCCCC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 12/20 0.61
▸ ALDH1A1 P00352 11/20 0.61
▸ HPGD P15428 8/20 0.61
▸ GLA P06280 5/20 0.61
▸ GAA P10253 5/20 0.61
▸ HSD17B10 Q99714 5/20 0.61
▸ SMN1; SMN2 Q16637 3/20 0.61
▸ MAPT P10636 2/20 0.61
▸ ALOX15 P16050 2/20 0.61
▸ HSP90AA1 P07900 1/20 0.61
▸ HSP90AB1 P08238 1/20 0.61
▸ ALPG P10696 1/20 0.61
▸ ALOX12 P18054 1/20 0.61
▸ CASP1 P29466 1/20 0.61
▸ CASP7 P55210 1/20 0.61
▸ KMT2A Q03164 5/20 0.57
▸ GFER P55789 1/20 0.50
▸ FPR1 P21462 1/20 0.50
▸ LMNA P02545 2/20 0.49
▸ MEN1 O00255 1/20 0.49

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
SCHEMBL6264833 1.00 KDM4E (0.61) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL6265896 1.00 KDM4E (0.61) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL6267523 1.00 KDM4E (0.61) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL8526039 0.92 KDM4E (0.53) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL8527989 0.91 ALDH1A1 (0.52) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL2184064 0.84 ALDH1A1 (0.49) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL2184062 0.84 ALDH1A1 (0.49) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL1095310 0.83 ALDH1A1 (0.84) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL381723 0.83 ALDH1A1 (0.84) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL3219473 0.83 ALDH1A1 (0.84) KDM4EALDH1A1HPGDGLAGAA

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
WO-2005091960-A2 METHOD FOR INHIBITING FIBROCARTILAGE DEGRADATION RUSH UNIVERSITY MEDICAL CENTER (US) 2005-10-06 — — WO disclosed
EP-0614896-B1 Esculetin derivatives and pharmaceutical composition KUREHA CHEMICAL IND CO LTD (JP) 1998-12-30 — — EP disclosed
US-5455268-A Treating arthropathy KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) 1995-10-03 — — US disclosed
EP-0614896-A1 Esculetin derivatives and pharmaceutical composition KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) 1994-09-14 — — EP disclosed
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