SCHEMBL25833222

SCHEMBL25833222

COCC(C)c1ccc(F)c(I)c1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36
SLC6A3 Q01959 2/20 0.36
ABCB11 O95342 1/20 0.33

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
SCHEMBL12891913 0.84 PDPK1 (0.39) SLC6A2SLC6A4SLC6A3ABCB11
SCHEMBL25833165 0.79 PARP1 (0.42) SLC6A2SLC6A4SLC6A3ABCB11
SCHEMBL19069421 0.79 SLC6A2 (0.55) SLC6A2SLC6A4SLC6A3
SCHEMBL17071856 0.79 SLC6A2 (0.55) SLC6A2SLC6A4SLC6A3
SCHEMBL16770633 0.79 SLC6A2 (0.55) SLC6A2SLC6A4SLC6A3
SCHEMBL16770677 0.77 SLC6A4 (0.39) SLC6A2SLC6A4SLC6A3
SCHEMBL16770784 0.77 SLC6A4 (0.39) SLC6A2SLC6A4SLC6A3
SCHEMBL25833224 0.76 AOC3 (0.33)
SCHEMBL19121496 0.75 LMNA (0.40)
SCHEMBL6058476 0.74 L3MBTL1 (0.38) SLC6A2SLC6A4SLC6A3ABCB11

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-11827637-B2 Azaindole derivatives and their use as ERK kinase inhibitors AGV DISCOVERY (FR) 2023-11-28 US disclosed
US-20230227451-A1 AZAINDOLE DERIVATIVES AND THEIR USE AS ERK KINASE INHIBITORS AGV DISCOVERY (FR) 2023-07-20 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 (2 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-11827637-B2 Azaindole derivatives and their use as ERK kinase inhibitors MAPKAPK2, MAPK1, MAPK7 SLC6A2 1803/4885SLC6A4 2807/4885SLC6A3 1676/4885
US-20230227451-A1 AZAINDOLE DERIVATIVES AND THEIR USE AS ERK KINASE INHIBITORS MAPKAPK2, MAPK1, MAPK7 SLC6A2 1803/4885SLC6A4 2807/4885SLC6A3 1676/4885

“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.