SCHEMBL10674591

SCHEMBL10674591

O=C(O)CC[C@H]1Oc2cc3c(cc2NC1=O)CCCC3

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 4/20 0.38
GAA P10253 3/20 0.38
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
USP2 O75604 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPK1 P28482 1/20 0.36
TSHR P16473 2/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL10674930 1.00 L3MBTL1 (0.39) L3MBTL1ALDH1A1GAAMEN1KMT2A
SCHEMBL10674600 1.00 L3MBTL1 (0.39) L3MBTL1ALDH1A1GAAMEN1KMT2A
SCHEMBL10681724 0.83 L3MBTL1 (0.44) L3MBTL1ALDH1A1GAAMEN1KMT2A
SCHEMBL10684965 0.83 L3MBTL1 (0.44) L3MBTL1ALDH1A1GAAMEN1KMT2A
SCHEMBL7142586 0.80 PARP1 (0.44) L3MBTL1ALDH1A1GAAMEN1KMT2A
SCHEMBL10768587 0.79 HSD17B10 (0.38) L3MBTL1ALDH1A1GAAMEN1KMT2A
SCHEMBL23830940 0.76 CYP3A4 (0.38) L3MBTL1ALDH1A1GAAMEN1KMT2A
SCHEMBL18302617 0.76 L3MBTL1 (0.38) L3MBTL1GAAMEN1KMT2AUSP2
SCHEMBL18209230 0.75 L3MBTL1 (0.47) L3MBTL1ALDH1A1GAAMEN1KMT2A
SCHEMBL18209232 0.75 L3MBTL1 (0.47) L3MBTL1ALDH1A1GAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4789675-A HYPOTENSIVE, ANTIISCHEMIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-12-06 US disclosed
EP-0233728-A1 1,4-Benzoxazine derivatives their production and use Takeda Chemical Industries, Ltd. (JP) 1987-08-26 EP disclosed