SCHEMBL9710841

SCHEMBL9710841

Cn1c(C#N)c(C#N)n(-c2ccccc2)c1=O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 7/20 0.50
GSK3A P49840 6/20 0.50
PGR P06401 2/20 0.47
NPSR1 Q6W5P4 1/20 0.42
MAPK1 P28482 2/20 0.41
GAA P10253 1/20 0.38
CYP1A2 P05177 2/20 0.38
HPGD P15428 2/20 0.38
CYP2C9 P11712 1/20 0.38
KMT2A Q03164 1/20 0.37
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MGLL Q99685 1/20 0.35

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
SCHEMBL9710619 0.85 GSK3B (0.46) GSK3BGSK3APGRNPSR1MAPK1
SCHEMBL9710690 0.84 ELANE (0.41) GSK3BGSK3APGRMAPK1KDM4E
SCHEMBL9710622 0.84 GSK3A (0.49) GSK3BGSK3ANPSR1MAPK1GAA
SCHEMBL9710822 0.83 GSK3A (0.50) GSK3BGSK3ANPSR1GAACYP1A2
SCHEMBL9710917 0.77 TDP2 (0.43) GSK3BGSK3ANPSR1GAAHPGD
SCHEMBL9710614 0.76 MAPT (0.42) KMT2AALDH1A1LMNA
SCHEMBL5199351 0.74 GSK3B (0.71) GSK3BGSK3APGRMAPK1GAA
SCHEMBL9710787 0.71 GSK3A (0.49) GSK3BGSK3ANPSR1GAACYP1A2
SCHEMBL8323908 0.70 ALDH1A1 (0.49) GSK3BGSK3APGRNPSR1MAPK1
SCHEMBL9710738 0.70 GSK3A (0.44) GSK3BGSK3ANPSR1GAAHPGD

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
WO-1992021662-A1 POSSIBLY CONDENSED PHENYLIMIDAZOLONES AND PYRIMIDINONES AS HERBICIDES; INTERMEDIATES DOWELANCO (US) 1992-12-10 WO disclosed
US-5153316-A Post and preemergence herbicides DOWELANCO 1992-10-06 US disclosed