SCHEMBL6958325

SCHEMBL6958325

Cc1ccccc1NCc1ccc2cc(CO)cnc2c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 2/20 0.46
SCD O00767 2/20 0.45
GAA P10253 2/20 0.44
HDAC8 Q9BY41 1/20 0.43
FAAH O00519 1/20 0.42
KDR P35968 4/20 0.41
MAPT P10636 4/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALPG P10696 1/20 0.41
KDM4E B2RXH2 2/20 0.40
NPC1 O15118 1/20 0.40
PKM P14618 1/20 0.40
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HTT P42858 2/20 0.39
ALDH1A1 P00352 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
SCHEMBL6958953 0.81 ADRA2C (0.45) ADRA2CSCDGAAHDAC8FAAH
SCHEMBL6960815 0.80 HPGDS (0.47) ADRA2CSCDHDAC8KDRHTT
SCHEMBL6964870 0.78 ALDH1A1 (0.44) SCDALDH1A1
SCHEMBL8825048 0.76 GSK3A (0.43) ADRA2CSCDGAAHDAC8FAAH
SCHEMBL8824925 0.72 GAA (0.38) ADRA2CSCDGAAHDAC8FAAH
SCHEMBL8824957 0.72 SCD (0.39) ADRA2CSCDGAAHDAC8FAAH
SCHEMBL553758 0.72 PDE10A (0.49) KMT2AKDM4EALDH1A1
SCHEMBL6956103 0.72 MAOA (0.48) GAAHDAC8MAPTNPC1RAB9A
SCHEMBL6958317 0.70 CRHBP (0.40) MEN1KMT2A
SCHEMBL30831434 0.70 ALDH1A1 (0.53) FAAHMAPTKMT2AKDM4ENPC1

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-0787725-B1 QUINOLINE DERIVATIVE NIPPON CHEMIPHAR CO (JP) 2003-04-23 EP disclosed
US-5693651-A HYPOGLYCEMIC AGENTS NIPPON CHEMIPHAR CO., LTD. (JP) 1997-12-02 US disclosed
EP-0787725-A1 QUINOLINE DERIVATIVE NIPPON CHEMIPHAR CO., LTD. (JP) 1997-08-06 EP disclosed