SCHEMBL11486708

SCHEMBL11486708

N#CC1=Cc2ccccc2Nc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.50
MAPT P10636 2/20 0.43
GAA P10253 1/20 0.43
LRRK2 Q5S007 2/20 0.38
PDGFRA P16234 1/20 0.38
FER P16591 1/20 0.38
LTK P29376 1/20 0.38
CDK8 P49336 1/20 0.38
ACVR1 Q04771 1/20 0.38
DYRK1B Q9Y463 1/20 0.38
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
RAB9A P51151 2/20 0.31
MAPK1 P28482 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CHEK1 O14757 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
IDO1 P14902 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 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
SCHEMBL3946811 0.78 GPR84 (0.62) GPR84MAPTGAAALDH1A1
Ethyne SCHEMBL28448752 0.74 GPR84 (0.58) GPR84
SCHEMBL13068587 0.71 MAPT (0.48) MAPTGAALRRK2PDGFRAFER
SCHEMBL11619520 0.71 GAA (0.48) MAPTGAALRRK2PDGFRAFER
SCHEMBL11621872 0.71 GAA (0.48) MAPTGAALRRK2PDGFRAFER
SCHEMBL11489366 0.71 MAPT (0.48) MAPTGAALRRK2PDGFRAFER
Bromide SCHEMBL11620749 0.69 GAA (0.46) MAPTGAALRRK2PDGFRAFER
Ammonia Solution, Strong SCHEMBL3949938 0.69 GPR84 (0.53) GPR84
SCHEMBL29624824 0.67 GPR84 (0.50) GPR84MAPTMAOARAB9AMAPK1
SCHEMBL2781483 0.67 GPR84 (0.50) GPR84MAPTMAOARAB9AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4235895-A FOR TREATING EPILEPSY CIBA-GEIGY CORPORATION (US) 1980-11-25 US disclosed
EP-0011603-A1 10-Nitrilo-5H-dibenz(b,f)azepine-5-carboxamide, process for its preparation and pharmaceutical compositions containing it CIBA-GEIGY AG (CH) 1980-05-28 EP disclosed