SCHEMBL7844950

SCHEMBL7844950

COC(=O)c1c(OC)ccc2c1C=CC(c1ccccc1)(c1ccccc1)C2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.36
HSD17B10 Q99714 2/20 0.36
KMT2A Q03164 5/20 0.36
MEN1 O00255 4/20 0.36
ALDH1A1 P00352 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
MAPT P10636 3/20 0.34
TSHR P16473 2/20 0.33
GAA P10253 2/20 0.33
MAPK1 P28482 2/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
RAB9A P51151 1/20 0.33
CASP1 P29466 1/20 0.33

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
SCHEMBL9111945 0.90 NCEH1 (0.34) KDM4EHSD17B10KMT2AMEN1ALDH1A1
SCHEMBL7839463 0.88 L3MBTL1 (0.38) KDM4EHSD17B10KMT2AL3MBTL1CA12
SCHEMBL7456709 0.87 KMT2A (0.42) KDM4EKMT2AMEN1ALDH1A1MAPT
SCHEMBL7770465 0.86 LMNA (0.35) KDM4EKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL6792314 0.86 CA12 (0.43) KDM4EHSD17B10KMT2AMEN1ALDH1A1
SCHEMBL7768682 0.84 HTT (0.40) KDM4EHSD17B10KMT2AMEN1ALDH1A1
SCHEMBL9114805 0.83 KDM4E (0.40) KDM4EHSD17B10KMT2AMEN1ALDH1A1
SCHEMBL8117763 0.82 GRK6 (0.32) KDM4EKMT2AMEN1ALDH1A1CA12
SCHEMBL7847009 0.82 CA12 (0.39) KDM4EHSD17B10KMT2AMEN1ALDH1A1
SCHEMBL7452626 0.82 NCEH1 (0.34) KDM4EKMT2AMEN1ALDH1A1L3MBTL1

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
EP-1097155-A2 PHOTOCHROMIC SIX-MEMBERED HETEROCYCLIC-FUSED NAPHTHOPYRANS TRANSITIONS OPTICAL, INC. (US) 2001-05-09 EP disclosed
WO-2000002883-A2 PHOTOCHROMIC SIX-MEMBERED HETEROCYCLIC-FUSED NAPHTHOPYRANS TRANSITIONS OPTICAL, INC. (US) 2000-01-20 WO disclosed