SCHEMBL7307166

SCHEMBL7307166

CCOC(=O)N(CCCCN1CC=C(c2ccccc2)CC1)c1cccc(Cl)c1C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.43
LMNA P02545 1/20 0.43
HTR7 P34969 5/20 0.42
SIGMAR1 Q99720 5/20 0.41
PARP1 P09874 2/20 0.41
HTR1A P08908 1/20 0.41
DRD4 P21917 1/20 0.41
HTR2A P28223 1/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 1/20 0.41
HTR2B P41595 1/20 0.41
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 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
SCHEMBL7310638 0.94 KDM4E (0.43) KDM4ELMNAHTR7SIGMAR1PARP1
SCHEMBL7359856 0.92 KDM4E (0.44) KDM4ELMNAHTR7SIGMAR1PARP1
SCHEMBL7303442 0.88 HTR7 (0.47) KDM4ELMNAHTR7SIGMAR1PARP1
SCHEMBL7308008 0.87 SIGMAR1 (0.42) KDM4EHTR7SIGMAR1PARP1HTR1A
SCHEMBL7308261 0.85 HTR7 (0.45) KDM4ELMNAHTR7SIGMAR1PARP1
SCHEMBL7307713 0.85 HTR7 (0.44) KDM4EHTR7SIGMAR1PARP1HTR1A
SCHEMBL7297468 0.85 DRD3 (0.41) KDM4EHTR7SIGMAR1PARP1HTR1A
SCHEMBL7306214 0.84 SIGMAR1 (0.46) KDM4ELMNAHTR7SIGMAR1PARP1
SCHEMBL7301503 0.83 HTR7 (0.43) KDM4EHTR7SIGMAR1PARP1HTR1A
SCHEMBL7302447 0.83 PARP1 (0.42) KDM4EHTR7SIGMAR1PARP1HTR1A

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
US-5304560-A Treating CNS disorders; dopamine receptor antagonist FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-04-19 US disclosed
CN-1060841-A Quinazoline derivant and preparation method thereof FUJISAWA PHARMACEUTICAL CO (JP) 1992-05-06 CN disclosed
EP-0481342-A1 Quinazoline derivatives and their preparation FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-04-22 EP disclosed