SCHEMBL9710867

SCHEMBL9710867

N#Cc1c(C#N)n(-c2ccc(Cl)cc2F)c(=O)n1Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.44
MAPK9 P45984 1/20 0.44
CNR1 P21554 2/20 0.43
AR P10275 3/20 0.40
PDE4A P27815 2/20 0.40
PDE4B Q07343 2/20 0.40
PDE4C Q08493 2/20 0.40
PDE4D Q08499 2/20 0.40
ALDH1A1 P00352 2/20 0.40
ALDH2 P05091 1/20 0.40
ALDH3A1 P30838 1/20 0.40
KDM4E B2RXH2 3/20 0.39
NPSR1 Q6W5P4 2/20 0.39
HPGD P15428 2/20 0.39
PPARG P37231 1/20 0.39
NCOA2 Q15596 1/20 0.39
NCOA1 Q15788 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.39
TP53 P04637 1/20 0.38

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
SCHEMBL9710842 0.80 RGS4 (0.50) MAPK8MAPK9CNR1ARPDE4A
SCHEMBL9711057 0.75 AOC3 (0.34) PDE4BPDE4D
SCHEMBL9711065 0.72 KDM4E (0.36) KDM4EKMT2ALMNAMEN1
SCHEMBL9710883 0.71 LMNA (0.35) ARPDE4BPDE4DALDH1A1KDM4E
SCHEMBL9710947 0.68 KDM4E (0.36) CNR1PDE4BPDE4DALDH1A1KDM4E
SCHEMBL31743576 0.66 CCR2 (0.54) MAPK8MAPK9ALDH1A1KDM4ENPSR1
SCHEMBL9710816 0.66 CCR2 (0.34) PDE4BPDE4DCCR2
SCHEMBL9710650 0.65 CCR2 (0.35) PDE4BPDE4DKMT2ACCR2
SCHEMBL5526856 0.65 PDE9A (0.52) MAPK8MAPK9CNR1ALDH1A1KDM4E
SCHEMBL31442447 0.63 ALDH1A1 (0.51) PDE4BPDE4DALDH1A1KDM4EKMT2A

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