SCHEMBL23916495

SCHEMBL23916495

CCC(F)(F)c1ccc(-c2ccc(N)cc2-c2nnn[nH]2)cn1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.33
PIK3CA P42336 1/20 0.33
KCNH2 Q12809 1/20 0.33
MINK1 Q8N4C8 1/20 0.33
PI4KB Q9UBF8 1/20 0.33
MTOR P42345 1/20 0.31
PDE10A Q9Y233 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
SCHEMBL23915977 0.88 KCNH2 (0.35) MAP4K4PIK3CAKCNH2MINK1PI4KB
SCHEMBL21135415 0.88 KCNH2 (0.41) MAP4K4PIK3CAKCNH2MINK1PI4KB
SCHEMBL23916420 0.79 HPGDS (0.36) PIK3CAPI4KBPDE10A
SCHEMBL20329856 0.79 PIK3CA (0.40) PIK3CAKCNH2PI4KB
SCHEMBL23916453 0.78 GLA (0.34)
SCHEMBL23916020 0.77 PDE5A (0.37) PIK3CAPI4KB
SCHEMBL23915989 0.76 PDE3B (0.31) MAP4K4
SCHEMBL23910009 0.76 MAP3K11 (0.41) PIK3CA
SCHEMBL21072312 0.76 MAPT (0.33)
SCHEMBL20329236 0.76 KCNH2 (0.41) PIK3CAKCNH2PI4KB

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-20210317092-A1 TETRAZOLE CONTAINING COMPOUNDS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2021-10-14 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-20210317092-A1 TETRAZOLE CONTAINING COMPOUNDS TSLP, IL5, TRPA1 MAP4K4 2906/4885PIK3CA 3273/4885KCNH2 1123/4885

“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.