SCHEMBL8065500

SCHEMBL8065500

COc1cccc(C(O)[C@@H]2CCCCC2=O)c1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.56
ALDH1A1 P00352 2/20 0.51
POLB P06746 1/20 0.49
HSD17B2 P37059 1/20 0.46
MAPK1 P28482 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CA1 P00915 1/20 0.42
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
HSD11B1 P28845 1/20 0.41
AOC3 Q16853 1/20 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
SCHEMBL8056693 1.00 MAPT (0.56) MAPTALDH1A1POLBHSD17B2MAPK1
SCHEMBL7483180 0.99 MAPT (0.55) MAPTALDH1A1POLBHSD17B2MAPK1
SCHEMBL7490400 0.99 MAPT (0.55) MAPTALDH1A1POLBHSD17B2MAPK1
SCHEMBL3485806 0.83 ALDH1A1 (0.55) MAPTALDH1A1HSD17B2MAPK1MEN1
SCHEMBL13254545 0.83 ALDH1A1 (0.55) MAPTALDH1A1HSD17B2MAPK1MEN1
SCHEMBL14292323 0.83 ALDH1A1 (0.55) MAPTALDH1A1HSD17B2MAPK1MEN1
SCHEMBL6676434 0.82 ALDH1A1 (0.49) ALDH1A1POLBMAPK1MEN1KMT2A
SCHEMBL7961084 0.82 MAPT (0.47) MAPTALDH1A1POLBMAPK1MEN1
SCHEMBL7053572 0.78 MAPT (0.61) MAPTALDH1A1POLBL3MBTL1CA1
SCHEMBL4754009 0.78 MAPT (0.61) MAPTALDH1A1POLBL3MBTL1CA1

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-0736018-B1 4,5-DIARYLOXAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2000-07-05 EP disclosed
US-6025375-A INHIBITORY ACTIVITY ON PLATELET AGGREGATION, VASODILATING ACTIVITY, ANTIHYPERTENSIVE ACTIVITY OR THE LIKE AND ARE PROSTAGLANDIN I.SUB.2 AGONISTS, FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-02-15 US disclosed
EP-0736018-A1 4,5-DIARYLOXAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-09 EP disclosed
WO-1995017393-A1 4,5-DIARYLOXAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-06-29 WO disclosed