SCHEMBL21028381

SCHEMBL21028381

C=C(CC)C(C)CCCCNC

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.38
KISS1R Q969F8 1/20 0.34
CA1 P00915 2/20 0.31

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
SCHEMBL19633500 0.85 HTR2A (0.30)
SCHEMBL23052584 0.82 CA1 (0.31) CA1
SCHEMBL21064497 0.79 CA1 (0.50) CA1
SCHEMBL13622892 0.79 CA1 (0.50) CA1
SCHEMBL21081931 0.78 KISS1R (0.35) EPHX1KISS1R
SCHEMBL21276538 0.78 EPHX1 (0.39) EPHX1KISS1R
SCHEMBL11388436 0.77 SMN1; SMN2 (0.36) CA1
SCHEMBL18508660 0.76 CA1 (0.41) CA1
SCHEMBL24235560 0.76 KISS1R (0.42) EPHX1KISS1RCA1
SCHEMBL24467918 0.75 CPB2 (0.35) EPHX1CA1

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-10301301-B2 Inhibitors of lysine gingipain Cortexyme, Inc. (US) 2019-05-28 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-10301301-B2 Inhibitors of lysine gingipain ENPEP, PHYKPL, PREP EPHX1 1202/4885KISS1R 245/4885CA1 651/4885

“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.