SCHEMBL20139362

SCHEMBL20139362

O=C(O)[C@@H]1CC2(CCN(C(=O)O)CC2)CN1C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.32
GRM3 Q14832 1/20 0.32
ALDH1A1 P00352 1/20 0.30
MAPK1 P28482 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL20139363 1.00 GRM2 (0.32) GRM2GRM3ALDH1A1MAPK1CYP2C19
SCHEMBL25364146 0.87 GRM2 (0.36) GRM2GRM3CYP2C19
SCHEMBL21806853 0.87 GRM2 (0.36) GRM2GRM3CYP2C19
SCHEMBL22636144 0.84 GRM2 (0.34) GRM2GRM3CYP2C19
SCHEMBL25365226 0.84 GRM2 (0.34) GRM2GRM3CYP2C19
SCHEMBL10179303 0.79 PEPD (0.34) GRM2GRM3
SCHEMBL20139027 0.79 CYP1A2 (0.34) GRM2GRM3
SCHEMBL20139024 0.79 CYP1A2 (0.34) GRM2GRM3
SCHEMBL10179199 0.79 GRM2 (0.32) GRM2GRM3
SCHEMBL22518862 0.78 CYP2C19 (0.33) GRM2GRM3CYP2C19

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11708365-B2 Processes for preparing TPH1 inhibitors ALTAVANT SCIENCES GMBH 2023-07-25 US disclosed
EP-3538530-B1 RESOLUTION OF OPTICALLY ACTIVE DIAZASPIRO[4.5]DECANE DERIVATIVES ALTAVANT SCIENCES GMBH (CH) 2022-01-05 EP disclosed
US-20210139481-A1 PROCESSES FOR PREPARING TPH1 INHIBITORS ALTAVANT SCIENCES GMBH (CH) 2021-05-13 US disclosed
EP-3538530-A1 RESOLUTION OF OPTICALLY ACTIVE DIAZASPIRO[4.5]DECANE DERIVATIVES Altavant Sciences GmbH (CH) 2019-09-18 EP disclosed
US-20190263815-A1 PROCESSES FOR PREPARING TPH1 INHIBITORS ALTAVANT SCIENCES GMBH (CH) 2019-08-29 US disclosed
WO-2018087602-A1 RESOLUTION OF OPTICALLY ACTIVE DIAZASPIRO[4.5]DECANE DERIVATIVES ROIVANT SCIENCES GMBH (CH) 2018-05-17 WO 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 (3 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-20190263815-A1 PROCESSES FOR PREPARING TPH1 INHIBITORS TPH1, TPH2, HTR1A GRM2 1904/4885GRM3 1693/4885ALDH1A1 197/4885
US-11708365-B2 Processes for preparing TPH1 inhibitors TPH1, TPH2, HTR1A GRM2 1963/4885GRM3 1749/4885ALDH1A1 194/4885
US-20210139481-A1 PROCESSES FOR PREPARING TPH1 INHIBITORS TPH1, TPH2, HTR1A GRM2 1963/4885GRM3 1749/4885ALDH1A1 194/4885

“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.