SCHEMBL25187516

SCHEMBL25187516

CC(C)[C@@H](CN1CCC1)C(=O)O.[LiH]

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
SLC1A3 P43003 1/20 0.39
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39
PIK3CD O00329 1/20 0.37
CHRM1 P11229 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
CHRM2 P08172 1/20 0.36
ADRA2B P18089 1/20 0.36
DRD3 P35462 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
POLB P06746 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL25264913 1.00 ALDH1A1 (0.42) ALDH1A1SLC1A3SLC1A2SLC1A1PIK3CD
SCHEMBL23886210 0.98 ALDH1A1 (0.43) ALDH1A1SLC1A3SLC1A2SLC1A1PIK3CD
SCHEMBL25191941 0.98 ALDH1A1 (0.43) ALDH1A1SLC1A3SLC1A2SLC1A1PIK3CD
SCHEMBL23898801 0.98 ALDH1A1 (0.43) ALDH1A1SLC1A3SLC1A2SLC1A1PIK3CD
SCHEMBL500153 0.80 MEN1 (0.45) ALDH1A1PIK3CDCHRM1MAPTHPGD
Lithium Ion SCHEMBL30017453 0.78 PIK3CD (0.36) ALDH1A1PIK3CDCHRM1MAPTHPGD
Lithium Ion SCHEMBL23886195 0.78 PIK3CD (0.36) ALDH1A1PIK3CDCHRM1MAPTHPGD
SCHEMBL23886340 0.77 ALDH1A1 (0.66) ALDH1A1PIK3CDCHRM1MAPTHPGD
SCHEMBL23886205 0.77 ALDH1A1 (0.66) ALDH1A1PIK3CDCHRM1MAPTHPGD
SCHEMBL23886134 0.77 ALDH1A1 (0.66) ALDH1A1PIK3CDCHRM1MAPTHPGD

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-20230150981-A1 N-HETEROARYLALKYL-2-(HETEROCYCLYL AND HETEROCYCLYLMETHYL) ACETAMIDE DERIVATIVES AS SSTR4 AGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-05-18 US disclosed
CN-115380030-A N-heteroarylalkyl-2- (heterocyclyl and heterocyclylmethyl) acetamide derivatives as SSTR4 agonists 武田药品工业株式会社 2022-11-22 CN 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-20230150981-A1 N-HETEROARYLALKYL-2-(HETEROCYCLYL AND HETEROCYCLYLMETHYL) ACETAMIDE DERIVATIVES AS SSTR4 AGONISTS SSTR4, SSTR3, SSTR5 ALDH1A1 2983/4885SLC1A3 1002/4885SLC1A2 1476/4885

“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.