SCHEMBL29326408

SCHEMBL29326408

CC(C)C(N)C(=O)N1CCC2(CC1)CC(C(C)(C)C)C2

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 16/20 0.40
DPP7 Q9UHL4 10/20 0.35
DPP8 Q6V1X1 9/20 0.35
DPP9 Q86TI2 6/20 0.35
FAP Q12884 3/20 0.35
PREP P48147 2/20 0.35
PITRM1 Q5JRX3 1/20 0.35
ARG1 P05089 2/20 0.35
CYP2D6 P10635 1/20 0.34
KCNH2 Q12809 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34

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
SCHEMBL29324711 0.85 CYP2D6 (0.36) CYP2D6KCNH2HRH3
SCHEMBL29324707 0.84 CYP2D6 (0.37) CYP2D6KCNH2HRH3
SCHEMBL16727344 0.80 CYP2D6 (0.53) DPP4DPP7DPP8DPP9FAP
SCHEMBL29324699 0.76 EPHX2 (0.45) CYP2D6
SCHEMBL29334537 0.75 DPP4 (0.34) DPP4CYP2D6KCNH2HRH3
SCHEMBL29317699 0.74 EPHX2 (0.39) CYP2D6KCNH2HRH3
SCHEMBL19981991 0.74 DPP4 (0.43) DPP4DPP7DPP8DPP9FAP
SCHEMBL21310237 0.74 DPP4 (0.44) DPP4DPP7DPP8DPP9FAP
SCHEMBL19386555 0.71 DPP4 (0.43) DPP4DPP7DPP8DPP9FAP
SCHEMBL29321295 0.71 CYP2D6 (0.43) CYP2D6KCNH2HRH3

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-20240239792-A1 MODULATORS OF BCL-2 OR BCL-2/BCL-XL AND USES THEREOF ASIA VISION LIMITED (CN) 2024-07-18 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-20240239792-A1 MODULATORS OF BCL-2 OR BCL-2/BCL-XL AND USES THEREOF BCL2, BCL2L2, BCL2L1 DPP4 3753/4885DPP7 2363/4885DPP8 3472/4885

“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.