SCHEMBL6987043

SCHEMBL6987043

CCC(C)c1nc2cc(F)cc(F)c2[nH]1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 1/20 0.35
ALPL P05186 1/20 0.30
ALPI P09923 1/20 0.30
ALPG P10696 1/20 0.30
AAK1 Q2M2I8 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
SCHEMBL23676453 0.84 GPR84 (0.47)
SCHEMBL6979886 0.83 KDM4E (0.41) ALPLALPIALPG
SCHEMBL22166615 0.81 ALPL (0.32) ALPLALPIALPG
SCHEMBL6985646 0.75 SCN10A (0.37) SCN10AALPLALPIALPGAAK1
SCHEMBL6986516 0.74 SCN10A (0.45) SCN10AALPLALPIALPGAAK1
SCHEMBL13544178 0.73 GAA (0.42)
SCHEMBL10061820 0.71 PARP1 (0.39)
SCHEMBL23676463 0.69 GPR84 (0.43)
SCHEMBL22962268 0.69 KDM4E (0.40) ALPLALPIALPG
SCHEMBL22962129 0.68 KDM4E (0.39)

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-20100324029-A1 THERAPEUTIC AGENTS MERCK SHARP & DOHME CORP. 2010-12-23 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-20100324029-A1 THERAPEUTIC AGENTS PSEN2, PSEN1, BACE2 SCN10A 3312/4885ALPL 3794/4885ALPI 1639/4885

“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.