SCHEMBL8633600

SCHEMBL8633600

O=C(O)c1cccc2cc3cc4ccccc4c-3[nH]c12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.60
GFER P55789 2/20 0.60
MAPT P10636 1/20 0.60
PIM1 P11309 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
DHODH Q02127 2/20 0.58
NR4A1 P22736 1/20 0.50
NR4A2 P43354 1/20 0.50
NR4A3 Q92570 1/20 0.50
PBRM1 Q86U86 1/20 0.47
MEN1 O00255 2/20 0.45
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45
KMT2A Q03164 2/20 0.45
HSD17B10 Q99714 2/20 0.45
USP2 O75604 1/20 0.45
CDC25B P30305 2/20 0.45
KEAP1 Q14145 1/20 0.45
PTPN1 P18031 1/20 0.44
GPR35 Q9HC97 2/20 0.42

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
SCHEMBL6487987 0.87 KDM4E (0.51) KDM4EGFERMAPTPIM1TDP1
SCHEMBL16474101 0.76 DHODH (0.94) KDM4EGFERMAPTPIM1TDP1
SCHEMBL6691511 0.75 KDM4E (1.00) KDM4EGFERMAPTPIM1TDP1
SCHEMBL9474474 0.74 DYRK1A (0.49) CDC25BCYP1A2
SCHEMBL505036 0.74 DHODH (1.00) KDM4EGFERMAPTPIM1TDP1
SCHEMBL11035155 0.74 HSD17B10 (0.62) KDM4EGFERMAPTPIM1TDP1
SCHEMBL7648523 0.73 KDM5B (0.60) KDM4EGFERMAPTPIM1TDP1
SCHEMBL8633602 0.73 KDM4E (0.50) KDM4EGFERMAPTPIM1TDP1
SCHEMBL29415464 0.72 DHODH (0.58) KDM4EGFERMAPTPIM1TDP1
SCHEMBL2808417 0.72 DHODH (0.58) KDM4EGFERMAPTPIM1TDP1

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-0601191-B1 NOVEL TETRACYCLIC COMPOUND KYOWA HAKKO KOGYO KK (JP) 1998-07-22 EP disclosed
US-5371225-A Immunosuppressants KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-12-06 US disclosed
EP-0601191-A1 NOVEL TETRACYCLIC COMPOUND KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1994-06-15 EP disclosed