SCHEMBL10652344

SCHEMBL10652344

CCN(CC)CCOc1ccc(Nc2c([N+](=O)[O-])ccc(Cl)c2C(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.50
KDR P35968 4/20 0.47
SRC P12931 2/20 0.47
FGFR1 P11362 2/20 0.47
ABL1 P00519 1/20 0.47
EGFR P00533 1/20 0.47
PDGFRB P09619 1/20 0.47
KIT P10721 1/20 0.47
BRAF P15056 1/20 0.47
EPHB4 P54760 1/20 0.47
TEK Q02763 1/20 0.47
LCK P06239 4/20 0.44
KCNH2 Q12809 1/20 0.42
MCHR1 Q99705 1/20 0.41
ESR1 P03372 3/20 0.41
WEE1 P30291 2/20 0.40
FGFR2 P21802 1/20 0.39
FGFR4 P22455 1/20 0.39
FGFR3 P22607 1/20 0.39

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
SCHEMBL10643617 0.89 ADAMTS5 (0.44)
SCHEMBL10645202 0.89 MAPT (0.44)
SCHEMBL10647647 0.87 KMT2A (0.49)
SCHEMBL3169532 0.81 MAPT (0.54)
SCHEMBL3177723 0.80 MEN1 (0.50)
SCHEMBL10652351 0.79 SMN1; SMN2 (0.46)
SCHEMBL3178123 0.78 MAPT (0.43)
SCHEMBL3177260 0.77 KMT2A (0.48)
SCHEMBL3178068 0.77 KMT2A (0.47) KIT
SCHEMBL10643719 0.77 MAPT (0.45)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0138302-B1 PYRAZOLO(3,4,5-KL)ACRIDINE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME AND PROCESSES FOR THEIR PRODUCTION WARNER-LAMBERT COMPANY (US) 1988-03-09 EP disclosed
US-4621086-A Method of treating leukemia with pyrazolo[3,4,5-kl]acridines WARNER-LAMBERT COMPANY (US) 1986-11-04 US disclosed
US-4588730-A Pyrazolo[3,4,5-k1]acridine compositions and methods for their use as antimicrobials WARNER-LAMBERT COMPANY (US) 1986-05-13 US disclosed
US-4555572-A Pyrazolo[3,4,5-kl]acridine compositions and methods for their production and use WARNER-LAMBERT COMPANY (US) 1985-11-26 US disclosed
EP-0138302-A1 Pyrazolo(3,4,5-kl)acridine compounds, pharmaceutical compositions comprising the same and processes for their production WARNER-LAMBERT COMPANY (US) 1985-04-24 EP disclosed