SCHEMBL10694404

SCHEMBL10694404

O=CN1CC2CC1CN2c1cc2c(cc1F)c(=O)c(OC(=O)O)cn2-c1ccc(F)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
KDM4E B2RXH2 6/20 0.45
ALDH1A1 P00352 4/20 0.45
HPGD P15428 3/20 0.45
HSD17B10 Q99714 3/20 0.45
GRM2 Q14416 1/20 0.33
TOP1 P11387 2/20 0.33
FAAH O00519 1/20 0.33
CYP1A2 P05177 1/20 0.32
TOP2A P11388 1/20 0.32
CYP2C9 P11712 1/20 0.32
TOP2B Q02880 1/20 0.32
EPHA2 P29317 1/20 0.31
FLT4 P35916 1/20 0.31
GSK3B P49841 1/20 0.31
RARB P10826 1/20 0.31
TBXAS1 P24557 1/20 0.31
SLC6A3 Q01959 1/20 0.31

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
SCHEMBL10368614 0.91 EPHA2 (0.37) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL9784874 0.90 LMNA (0.58) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL10692192 0.89 LMNA (0.52) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL10690510 0.84 LMNA (0.45) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL10370861 0.83 LMNA (0.43) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL10690288 0.82 LMNA (0.48) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL9784901 0.81 EPHA2 (0.47) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL9669597 0.80 LMNA (0.50) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL10370052 0.80 LMNA (0.41) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL9213760 0.79 LMNA (0.50) LMNAMEN1KMT2AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0251308-A1 4-Quinolone-3-carboxylic-acid derivatives, process for their synthesis and pharmaceutical preparations containing them Chemie Linz Gesellschaft m.b.H. (AT) 1988-01-07 EP disclosed