SCHEMBL8107014

SCHEMBL8107014

CCOc1ccc2c(=O)cc(C(=O)OC)oc2c1

nearest known ligand 0.76

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.76
SLC2A1 P11166 1/20 0.64
ALDH1A1 P00352 6/20 0.58
AKR1B1 P15121 2/20 0.57
POLB P06746 2/20 0.54
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
HPGD P15428 3/20 0.52
HSD17B10 Q99714 2/20 0.52
HSP90AA1 P07900 1/20 0.52
TSHR P16473 1/20 0.52
RAB9A P51151 1/20 0.52
MAPT P10636 5/20 0.52
LOXL2 Q9Y4K0 1/20 0.50
PRKDC P78527 1/20 0.49
GAA P10253 2/20 0.49
MAOB P27338 1/20 0.48
SMN1; SMN2 Q16637 1/20 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
SCHEMBL8107902 0.90 KDM4E (0.72) KDM4ESLC2A1ALDH1A1AKR1B1POLB
SCHEMBL432503 0.90 SLC2A1 (0.78) KDM4ESLC2A1ALDH1A1AKR1B1POLB
SCHEMBL426292 0.86 KDM4E (0.72) KDM4ESLC2A1ALDH1A1AKR1B1POLB
SCHEMBL8115968 0.86 SLC2A1 (0.60) KDM4ESLC2A1ALDH1A1AKR1B1POLB
SCHEMBL8107875 0.86 KDM4E (1.00) KDM4ESLC2A1ALDH1A1AKR1B1MEN1
SCHEMBL24496704 0.83 SLC2A1 (0.72) KDM4ESLC2A1ALDH1A1AKR1B1MEN1
SCHEMBL5322779 0.82 KDM4E (0.76) KDM4ESLC2A1ALDH1A1AKR1B1MEN1
SCHEMBL8115506 0.81 SLC2A1 (0.73) KDM4ESLC2A1ALDH1A1AKR1B1MEN1
SCHEMBL10459171 0.79 SLC2A1 (0.71) KDM4ESLC2A1ALDH1A1AKR1B1MEN1
SCHEMBL4254491 0.79 KDM4E (0.72) KDM4ESLC2A1ALDH1A1AKR1B1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0634409-B1 Process of producing 2-cyano-4-oxo-4H-benzopyran compounds SUMITOMO CHEMICAL CO (JP) 2000-04-26 EP disclosed
US-5659051-A Process of producing 2-cyano-4-oxo-4H-benzopyran compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-08-19 US disclosed
EP-0634409-A1 Process of producing 2-cyano-4-oxo-4H-benzopyran compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-01-18 EP disclosed