SCHEMBL4922720

SCHEMBL4922720

CC(C)C(C)Nc1c(-c2c(F)cc(F)cc2F)c(F)nc2ncc(-c3ccc(F)cc3)nc12

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.38
MAPK14 Q16539 15/20 0.36
SCN9A Q15858 1/20 0.33
MAPK1 P28482 1/20 0.33
SGK1 O00141 1/20 0.32
MET P08581 1/20 0.32

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
SCHEMBL14007184 0.93 MET (0.36) NOS1MAPK14MET
SCHEMBL14007180 0.88 MAPK14 (0.39) NOS1MAPK14SCN9AMAPK1MET
SCHEMBL14007177 0.84 NOS1 (0.38) NOS1MAPK14MAPK1SGK1MET
SCHEMBL14007181 0.81 MET (0.35) NOS1MAPK14MET
SCHEMBL5321926 0.79 MAPK14 (0.32) MAPK14
SCHEMBL5321924 0.79 MAPK14 (0.32) MAPK14
SCHEMBL4918755 0.79 NOS1 (0.46) NOS1MAPK1SGK1MET
SCHEMBL14007182 0.77 MAP4K4 (0.39) NOS1MAPK14MET
SCHEMBL14007178 0.75 MAP4K4 (0.39) NOS1MAPK14MAPK1SGK1MET
SCHEMBL4927202 0.71 NOS1 (0.41) NOS1MET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080280766-A1 Pyridopyrazines for Combating Phytopathogenic Fungi SYNGENTA CROP PROTECTION, INC. (US) 2008-11-13 US disclosed
US-20080280766-A1 Pyridopyrazines for Combating Phytopathogenic Fungi SYNGENTA CROP PROTECTION, INC. (US) 2008-11-13 US disclosed
US-20080280766-A1 Pyridopyrazines for Combating Phytopathogenic Fungi SYNGENTA CROP PROTECTION, INC. (US) 2008-11-13 US disclosed
EP-1758901-A1 PYRIDOPYRAZINES FOR COMBATTING PHYTOPATHOGENIC FUNGI Syngeta Participations AG (CH) 2007-03-07 EP disclosed
WO-2005123733-A1 PYRIDOPYRAZINES FOR COMBATTING PHYTOPATHOGENIC FUNGI SYNGENTA PARTICIPATIONS AG (CH) 2005-12-29 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080280766-A1 Pyridopyrazines for Combating Phytopathogenic Fungi Q6ZSR9, GRHPR, PRXL2A NOS1 1227/4885MAPK14 2837/4885SCN9A 2198/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.