SCHEMBL6200680

SCHEMBL6200680

Nc1ccc(F)c(-n2ccnc2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
MAPT P10636 2/20 0.53
IDO1 P14902 4/20 0.53
CYP3A4 P08684 3/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2D6 P10635 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPK1 P28482 1/20 0.42
PMP22 Q01453 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CYP11B1 P15538 4/20 0.42
CYP11B2 P19099 4/20 0.42
CYP19A1 P11511 2/20 0.42
NOTUM Q6P988 1/20 0.41
GAA P10253 1/20 0.40
CD38 P28907 1/20 0.39

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
SCHEMBL1354709 0.86 LMNA (0.53) LMNAMAPTIDO1CYP3A4CYP1A2
SCHEMBL19036229 0.84 LMNA (0.58) LMNAMAPTIDO1CYP3A4CYP1A2
SCHEMBL8335380 0.82 IDO1 (0.47) LMNAMAPTIDO1CYP3A4CYP1A2
SCHEMBL2657862 0.79 IDO1 (0.45) LMNAMAPTIDO1CYP3A4CYP1A2
SCHEMBL28783073 0.79 LMNA (0.53) LMNAMAPTIDO1CYP3A4CYP1A2
SCHEMBL2666052 0.79 CYP19A1 (0.45) LMNAMAPTIDO1CYP3A4CYP1A2
SCHEMBL8059739 0.79 IDO1 (0.51) LMNAMAPTIDO1CYP3A4CYP1A2
SCHEMBL2357181 0.78 ALDH1A1 (0.36) LMNAMAPTIDO1MEN1ALDH1A1
SCHEMBL29123875 0.77 LMNA (0.54) LMNAMAPTIDO1CYP3A4CYP1A2
SCHEMBL6835451 0.76 MAPT (0.53) LMNAMAPTIDO1CYP3A4CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1343788-B1 IMIDAZO-TRIAZINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS MERCK SHARP & DOHME (GB) 2005-11-23 EP disclosed
US-6936608-B2 Imidazo-triazine derivatives as ligands for GABA receptors MERCK SHARP & DOHME LTD. 2005-08-30 US disclosed
US-20040023964-A1 Imidazo-triazine derivatives as ligands for gaba receptors MERCK SHARP & DOHME LTD. (GB) 2004-02-05 US 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-20040023964-A1 Imidazo-triazine derivatives as ligands for gaba receptors GABRA2, GABRA5, GABRA1 LMNA 4080/4885MAPT 517/4885IDO1 706/4885

“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.