SCHEMBL9710845

SCHEMBL9710845

Cn1c(C#N)c(Cl)n(-c2ccc(F)cc2)c1=O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 2/20 0.46
GSK3B P49841 2/20 0.46
KDM4E B2RXH2 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 2/20 0.40
MAPT P10636 2/20 0.40
KMT2A Q03164 2/20 0.40
MITF O75030 1/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
ALDH1A1 P00352 3/20 0.38
MGLL Q99685 1/20 0.36
TP53 P04637 1/20 0.35
PTGS2 P35354 2/20 0.34
DHODH Q02127 1/20 0.34
HPGD P15428 1/20 0.33
GAA P10253 1/20 0.33
HSD17B10 Q99714 1/20 0.33
GSR P00390 1/20 0.33

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
SCHEMBL9710787 0.88 GSK3A (0.49) GSK3AGSK3BKDM4ESMN1; SMN2MEN1
SCHEMBL9710970 0.86 GSK3A (0.45) GSK3AGSK3BKDM4ESMN1; SMN2MEN1
SCHEMBL9710619 0.84 GSK3B (0.46) GSK3AGSK3BKDM4EKMT2AALDH1A1
SCHEMBL9710731 0.84 GSK3A (0.50) GSK3AGSK3BPTGS2DHODHGAA
SCHEMBL9710903 0.81 POLB (0.44) ALDH1A1PTGS2
SCHEMBL9710679 0.81 MAPT (0.41) MEN1MAPTKMT2ALMNAHTT
SCHEMBL9710800 0.79 GSK3A (0.50) GSK3AGSK3BKDM4ESMN1; SMN2MEN1
SCHEMBL9710822 0.76 GSK3A (0.50) GSK3AGSK3BKDM4ESMN1; SMN2MEN1
SCHEMBL9710669 0.73 GSK3A (0.46) GSK3AGSK3BKDM4ESMN1; SMN2MEN1
SCHEMBL9711118 0.73 MGLL (0.41) KDM4ESMN1; SMN2MAPTKMT2AALDH1A1

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