SCHEMBL5625243

SCHEMBL5625243

CCCn1c(Cn2ccnc2-c2cccc(F)n2)nc2cc(-c3nnco3)ncc21

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TP53 P04637 1/20 0.31
ALOX5AP P20292 1/20 0.31
NOTUM Q6P988 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
SCHEMBL3064978 0.89 MAPT (0.37) MEN1GAAMAPTRAB9AKMT2A
SCHEMBL3059668 0.88 MAPT (0.37) MEN1GAAMAPTRAB9AKMT2A
SCHEMBL5624309 0.87 TP53 (0.32) TP53ALOX5AP
SCHEMBL13089665 0.86 NOTUM (0.33) MEN1GAAMAPTRAB9AKMT2A
SCHEMBL3072824 0.85 MEN1 (0.35) MEN1GAAMAPTRAB9AKMT2A
SCHEMBL3063108 0.80 TP53 (0.35) MEN1MAPTKMT2ATP53ALOX5AP
SCHEMBL13089664 0.79 CYP11B2 (0.39) MEN1RAB9AKMT2ATP53ALOX5AP
SCHEMBL3060407 0.79 RPS6KA5 (0.37) MEN1GAAMAPTRAB9AKMT2A
SCHEMBL3061511 0.78 ALOX5AP (0.36) TP53ALOX5AP
SCHEMBL5627613 0.77 TP53 (0.37) MEN1GAAMAPTRAB9AKMT2A

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
US-7300945-B2 Benzimidazole and pyridylimidazole derivatives NEUROGEN CORPORATION (US) 2007-11-27 US disclosed
US-20060025425-A1 Benzimidazole and pyridylimidazole derivatives NEUROGEN CORPORATION 2006-02-02 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-20060025425-A1 Benzimidazole and pyridylimidazole derivatives GABBR1, GABBR2, GABRA2 MEN1 3395/4885GAA 1402/4885MAPT 1046/4885

“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.