SCHEMBL14649965

SCHEMBL14649965

CCC(=O)N1[C@@H](C)CC[C@H]1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACE P12821 1/20 0.54
ALDH1A1 P00352 3/20 0.51
KMT2A Q03164 2/20 0.42
GLA P06280 1/20 0.37
HPGD P15428 1/20 0.37
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
DPP4 P27487 1/20 0.33
CHRNB2 P17787 2/20 0.32
CHRNA3 P32297 2/20 0.32
CHRNA4 P43681 2/20 0.32
RECQL P46063 1/20 0.32
CHRNB3 Q05901 1/20 0.32
CHRNA6 Q15825 1/20 0.32
PHGDH O43175 1/20 0.32
MEN1 O00255 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA7 P36544 1/20 0.32
MAPT P10636 1/20 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
SCHEMBL14649967 1.00 ACE (0.54) ACEALDH1A1KMT2AGLAHPGD
SCHEMBL18160593 1.00 ACE (0.54) ACEALDH1A1KMT2AGLAHPGD
SCHEMBL18160591 1.00 ACE (0.54) ACEALDH1A1KMT2AGLAHPGD
SCHEMBL18160588 1.00 ACE (0.54) ACEALDH1A1KMT2AGLAHPGD
SCHEMBL14649966 1.00 ACE (0.54) ACEALDH1A1KMT2AGLAHPGD
SCHEMBL18994459 0.83 ALDH1A1 (0.43) ACEALDH1A1KMT2AGLAHPGD
SCHEMBL13612710 0.83 ALDH1A1 (0.43) ACEALDH1A1KMT2AGLAHPGD
SCHEMBL3038063 0.83 ACE (0.53) ACEALDH1A1KMT2AGLAHPGD
SCHEMBL14649968 0.80 ACE (0.36) ACEALDH1A1KMT2AKDM4ESMN1; SMN2
SCHEMBL18160592 0.80 ACE (0.36) ACEALDH1A1KMT2AKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10017468-B2 Substituted pyrrolidines as G-protein coupled receptor 43 agonists OGEDA SA (BE) 2018-07-10 US disclosed
US-20170283376-A1 SUBSTITUTED PYRROLIDINES AS G-PROTEIN COUPLED RECEPTOR 43 AGONISTS EPICS THERAPEUTICS (BE) 2017-10-05 US disclosed
US-9695120-B2 Substituted pyrrolidines as G-protein coupled receptor 43 agonists OGEDA SA (BE) 2017-07-04 US disclosed
WO-2016007534-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2016-01-14 WO disclosed
US-20130023539-A1 PYRROLIDINE OR THIAZOLIDINE CARBOXYLIC ACID DERIVATIVES, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS AS AGONISTS OF G-PROTEIN COUPLED RECEPTOR 43 (GPR43) EUROSCREEN S.A. (BE) 2013-01-24 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 (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-10017468-B2 Substituted pyrrolidines as G-protein coupled receptor 43 agonists GIPR, GPR88, FFAR3 ACE 1566/4885ALDH1A1 1764/4885KMT2A 3710/4885
US-20130023539-A1 PYRROLIDINE OR THIAZOLIDINE CARBOXYLIC ACID DERIVATIVES, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS AS AGONISTS OF G-PROTEIN COUPLED RECEPTOR 43 (GPR43) GPR119, GPR65, GPR84 ACE 2081/4885ALDH1A1 1118/4885KMT2A 4194/4885
US-20170283376-A1 SUBSTITUTED PYRROLIDINES AS G-PROTEIN COUPLED RECEPTOR 43 AGONISTS GPR119, GPR52, GPR88 ACE 2379/4885ALDH1A1 1244/4885KMT2A 4423/4885

“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.