SCHEMBL8107902

SCHEMBL8107902

CCCOc1ccc2c(=O)cc(C(=O)OC)oc2c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.72
ALDH1A1 P00352 6/20 0.65
MEN1 O00255 1/20 0.65
KMT2A Q03164 1/20 0.65
SLC2A1 P11166 1/20 0.58
HPGD P15428 3/20 0.56
TSHR P16473 3/20 0.56
HSD17B10 Q99714 3/20 0.56
RAB9A P51151 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
MAOB P27338 2/20 0.55
PRKDC P78527 2/20 0.54
AKR1B1 P15121 2/20 0.52
MAPT P10636 3/20 0.50
MAPK1 P28482 1/20 0.50
POLB P06746 1/20 0.50
HSP90AA1 P07900 1/20 0.50
HDAC1 Q13547 1/20 0.49
MAOA P21397 1/20 0.48
CA12 O43570 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
SCHEMBL8107014 0.90 KDM4E (0.76) KDM4EALDH1A1MEN1KMT2ASLC2A1
SCHEMBL8115506 0.89 SLC2A1 (0.73) KDM4EALDH1A1MEN1KMT2ASLC2A1
SCHEMBL8115562 0.87 PRKDC (0.56) KDM4EALDH1A1MEN1KMT2ASLC2A1
SCHEMBL8107875 0.84 KDM4E (1.00) KDM4EALDH1A1MEN1KMT2ASLC2A1
SCHEMBL9847137 0.80 KDM4E (0.66) KDM4EALDH1A1MEN1KMT2ASLC2A1
SCHEMBL10459171 0.80 SLC2A1 (0.71) KDM4EALDH1A1MEN1KMT2ASLC2A1
SCHEMBL432503 0.80 SLC2A1 (0.78) KDM4EALDH1A1SLC2A1HPGDSMN1; SMN2
SCHEMBL24496704 0.78 SLC2A1 (0.72) KDM4EALDH1A1MEN1KMT2ASLC2A1
SCHEMBL8223059 0.78 MAOA (0.67) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL3834564 0.77 KDM4E (0.67) KDM4EALDH1A1MEN1KMT2ASLC2A1

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