SCHEMBL7709465

SCHEMBL7709465

COc1cc2c3c(cccc3c1OC)C(=O)OC2=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
KDM4E B2RXH2 4/20 0.47
MAPT P10636 3/20 0.47
ALDH1A1 P00352 2/20 0.47
LMNA P02545 1/20 0.47
PABPC1 P11940 1/20 0.47
XBP1 P17861 1/20 0.47
NFKB1 P19838 1/20 0.47
HTT P42858 1/20 0.47
SMARCA2 P51531 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
TYMS P04818 3/20 0.46
MAOA P21397 1/20 0.45
PRMT1 Q99873 1/20 0.44
CTSV O60911 1/20 0.42
NPC1 O15118 1/20 0.42
SMN1; SMN2 Q16637 1/20 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
SCHEMBL7709648 0.83 TYMS (0.45) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL6548245 0.80 KMT2A (0.76) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL12486030 0.80 ALDH1A1 (0.47) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL30761754 0.80 KMT2A (0.76) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL7706740 0.80 KMT2A (0.47) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL9079018 0.79 KMT2A (0.49) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL7712214 0.79 MAPT (0.71) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL7712218 0.79 KMT2A (0.46) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL13495352 0.78 KMT2A (0.54) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL7703768 0.74 ALDH1A1 (0.47) POLBKMT2AMEN1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6362181-B1 BACTERICIDES; ENZYME INHIBITORS; ANTITUMOR AGENTS WARNER-LAMBERT COMPANY 2002-03-26 US disclosed
US-6177423-B1 N-(HYDROXY OR PROTECTED HYDROXY)-BENZO(DE)ISOQUINOLINE-1,3-DIONE DERIVATIVES; BACTERIAL DNA GYRASE AND DNA TOPOISOMERASE INHIBITORS USEFUL FOR ANTIBACTERIAL AGENTS HAVING REDUCED DRUG RESISTANCE AND REDUCED SIDE EFFECTS WARNER-LAMBERT COMPANY 2001-01-23 US disclosed
EP-0939754-A2 N-OXY-NAPHTHALIMIDES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1999-09-08 EP disclosed
WO-1998019648-A2 N-OXY-NAPHTHALIMIDES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1998-05-14 WO disclosed