SCHEMBL7709607

SCHEMBL7709607

COc1cc2c3c(cccc3c1N1CCOCC1)C(=O)N(O)C2=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.56
MAPT P10636 5/20 0.56
LMNA P02545 5/20 0.56
HTT P42858 4/20 0.56
POLB P06746 3/20 0.56
ALDH1A1 P00352 2/20 0.56
XBP1 P17861 2/20 0.56
KDM4E B2RXH2 1/20 0.56
PABPC1 P11940 1/20 0.56
NFKB1 P19838 1/20 0.56
SMARCA2 P51531 1/20 0.56
NFKB2 Q00653 1/20 0.56
RELA Q04206 1/20 0.56
MEN1 O00255 4/20 0.47
CYP1A2 P05177 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
PRKDC P78527 5/20 0.46

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
SCHEMBL7712199 0.90 KMT2A (0.64) KMT2AMAPTLMNAHTTPOLB
SCHEMBL7706806 0.88 KMT2A (0.62) KMT2AMAPTLMNAHTTPOLB
SCHEMBL7709605 0.87 MAPT (0.57) KMT2AMAPTLMNAHTTPOLB
SCHEMBL11672984 0.83 PRKDC (0.47) KMT2AMAPTLMNAPOLBALDH1A1
SCHEMBL7709336 0.81 CYP1A2 (0.46) KMT2AMAPTLMNAALDH1A1MEN1
SCHEMBL7709645 0.81 POLB (0.52) KMT2AMAPTLMNAHTTPOLB
SCHEMBL7712214 0.78 MAPT (0.71) KMT2AMAPTLMNAHTTPOLB
SCHEMBL7712239 0.75 MEN1 (0.72) KMT2AMAPTLMNAHTTPOLB
SCHEMBL7709844 0.75 KMT2A (0.68) KMT2AMAPTLMNAHTTPOLB
SCHEMBL7709426 0.75 KMT2A (0.68) KMT2AMAPTLMNAHTTPOLB

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 6 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 claimed
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 claimed
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