SCHEMBL3788134

SCHEMBL3788134

FC(F)(F)c1cc(-c2ccoc2)cn2c(Cl)cnc12

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.40
NPBWR1 P48145 1/20 0.33
NT5E P21589 3/20 0.32
PIK3CD O00329 1/20 0.32
BRAF P15056 1/20 0.31
GRM5 P41594 1/20 0.30

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
SCHEMBL3693551 0.79 ERN1 (0.39) ERN1NPBWR1NT5EGRM5
SCHEMBL3683451 0.78 ERN1 (0.38) ERN1NPBWR1NT5EPIK3CDGRM5
SCHEMBL3688421 0.75 ERN1 (0.36) ERN1NPBWR1NT5EGRM5
SCHEMBL3689147 0.75 CSNK2A1 (0.36) ERN1NPBWR1NT5EGRM5
SCHEMBL1583247 0.74 ERN1 (0.40) ERN1NPBWR1NT5E
SCHEMBL1583278 0.73 ERN1 (0.40) ERN1NPBWR1NT5E
SCHEMBL3693692 0.73 ERN1 (0.40) ERN1NPBWR1NT5E
Potassium Ion SCHEMBL1583281 0.72 ERN1 (0.39) ERN1NPBWR1NT5E
SCHEMBL3793277 0.71 NOTUM (0.41) ERN1
SCHEMBL3789342 0.70 ERN1 (0.38) ERN1NPBWR1GRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100204265-A1 Certain Nitrogen Containing Bicyclic Chemical Entities for Treating Viral Infections GENELABS TECHNOLOGIES, INC. 2010-08-12 US claimed

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-20100204265-A1 Certain Nitrogen Containing Bicyclic Chemical Entities for Treating Viral Infections OAT, HAVCR2, CPS1 ERN1 237/4885NPBWR1 3024/4885NT5E 171/4885

“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.