SCHEMBL7203928

SCHEMBL7203928

CCOC(=O)C(C(=O)OCC)c1c(C(=O)c2cccc(C)c2)[nH]c2ccc(OC)cc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.52
KDM4E B2RXH2 5/20 0.52
HPGD P15428 4/20 0.52
MAPT P10636 3/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
KMT2A Q03164 5/20 0.52
MEN1 O00255 4/20 0.52
GAA P10253 3/20 0.52
TUBB4A P04350 3/20 0.48
TUBB P07437 3/20 0.48
TUBA3C P0DPH7 3/20 0.48
TUBA1B P68363 3/20 0.48
TUBA4A P68366 3/20 0.48
TUBB4B P68371 3/20 0.48
TUBB3 Q13509 3/20 0.48
TUBB2A Q13885 3/20 0.48
TUBB8 Q3ZCM7 3/20 0.48
TUBA3E Q6PEY2 3/20 0.48
TUBA1A Q71U36 3/20 0.48

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
SCHEMBL6172246 0.89 KMT2A (0.45) ALDH1A1KDM4EHPGDMAPTNPC1
SCHEMBL7206101 0.87 ALDH1A1 (0.48) ALDH1A1KDM4EHPGDMAPTNPC1
SCHEMBL7206121 0.80 ALOX15 (0.48) ELANE
SCHEMBL7203961 0.80 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDMAPTRAB9A
SCHEMBL8140740 0.78 MEN1 (0.49) ALDH1A1KDM4EHPGDMAPTNPC1
SCHEMBL6168282 0.78 PTGS2 (0.68) ALDH1A1KDM4EHPGDMAPTNPC1
SCHEMBL6168601 0.78 KMT2A (0.48) ALDH1A1KDM4EHPGDMAPTNPC1
SCHEMBL27569322 0.78 KMT2A (0.46) ALDH1A1KDM4EHPGDMAPTNPC1
SCHEMBL7205567 0.77 ALDH1A1 (0.42) ALDH1A1KDM4EHPGDMAPTRAB9A
SCHEMBL7206948 0.77 KDM4E (0.48) ALDH1A1KDM4EHPGDMAPTNPC1

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-6608070-B1 Useful for treatment of medical condition in which prostaglandins are implicated as pathogens NAKAO KAZUNARI (JP) 2003-08-19 US disclosed