SCHEMBL25099271

SCHEMBL25099271

CC(C)C(=O)N1CCC[C@H]1C(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.50
DPP4 P27487 10/20 0.42
DPP7 Q9UHL4 8/20 0.42
FAP Q12884 5/20 0.42
DPP8 Q6V1X1 4/20 0.42
PREP P48147 4/20 0.42
DPP9 Q86TI2 3/20 0.42
ACE P12821 5/20 0.40
REN P00797 3/20 0.40
PITRM1 Q5JRX3 1/20 0.40
KDM4E B2RXH2 1/20 0.40
F2 P00734 1/20 0.40
LMNA P02545 1/20 0.40
LTA4H P09960 1/20 0.40
MAPT P10636 1/20 0.40
PEPD P12955 1/20 0.40
ALOX15 P16050 1/20 0.40
PTGS1 P23219 1/20 0.40
HTR2A P28223 1/20 0.40
PTGS2 P35354 1/20 0.40

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
SCHEMBL13252946 1.00 PIK3CD (0.50) PIK3CDDPP4DPP7FAPDPP8
SCHEMBL17471258 0.94 PIK3CD (0.49) PIK3CDDPP4DPP7FAPDPP8
SCHEMBL23408433 0.94 PIK3CD (0.49) PIK3CDDPP4DPP7FAPDPP8
SCHEMBL24827448 0.88 PIK3CD (0.53) PIK3CDDPP4DPP7FAPDPP8
SCHEMBL23408415 0.88 PIK3CD (0.53) PIK3CDDPP4DPP7FAPDPP8
SCHEMBL16160776 0.88 PIK3CD (0.53) PIK3CDDPP4DPP7FAPDPP8
SCHEMBL15576320 0.85 DPP4 (0.41) PIK3CDDPP4DPP7FAPDPP8
SCHEMBL15829017 0.85 DPP4 (0.41) DPP4DPP7FAPDPP8PREP
SCHEMBL18348008 0.85 DPP4 (0.40) PIK3CDDPP4DPP7FAPDPP8
SCHEMBL16433388 0.82 DPP4 (0.42) PIK3CDDPP4DPP7FAPDPP8

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-20230077316-A1 CTPS1 INHIBITORS AND USES THEREOF NIMBUS DISCOVERY, INC. 2023-03-09 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-20230077316-A1 CTPS1 INHIBITORS AND USES THEREOF CTPS1, CTPS2, ECHS1 PIK3CD 1870/4885DPP4 2096/4885DPP7 1776/4885

“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.