SCHEMBL18774975

SCHEMBL18774975

CC(C)C[C@H](N)C(=O)N(C)CC(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.50
ANPEP P15144 7/20 0.42
RNPEP Q9H4A4 2/20 0.42
DNPEP Q9ULA0 2/20 0.42
SLC1A3 P43003 3/20 0.39
SLC1A2 P43004 3/20 0.39
SLC1A1 P43005 2/20 0.37
DPP4 P27487 2/20 0.36
DPP9 Q86TI2 1/20 0.36
LAP3 P28838 2/20 0.34
ERAP1 Q9NZ08 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
AAK1 Q2M2I8 1/20 0.33
LARS1 Q9P2J5 1/20 0.33

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
SCHEMBL18774977 0.81 SLC7A5 (0.52) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL19882799 0.80 DPP4 (0.38) SLC7A5SLC1A3SLC1A2SLC1A1DPP4
SCHEMBL1911122 0.80 SLC7A5 (0.56) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL4595827 0.80 SLC7A5 (0.56) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL4594704 0.80 SLC7A5 (0.56) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL11459947 0.80 SLC7A5 (0.52) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL15840409 0.80 SLC7A5 (0.47) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL11459948 0.80 SLC7A5 (0.52) SLC7A5ANPEPRNPEPDNPEPSLC1A3
Hydrochloric Acid SCHEMBL56160 0.78 SLC7A5 (0.54) SLC7A5ANPEPRNPEPDNPEPSLC1A3
Hydrochloric Acid SCHEMBL3223338 0.78 SLC7A5 (0.54) SLC7A5ANPEPRNPEPDNPEPSLC1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11679090-B2 Modulators of Sestrin-GATOR2 interaction and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2023-06-20 US disclosed
US-11679090-B2 Modulators of Sestrin-GATOR2 interaction and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2023-06-20 US disclosed
US-11325924-B2 Modulators of Sestrin-GATOR2 interaction and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2022-05-10 US disclosed
US-20210228523-A1 MODULATORS OF SESTRIN-GATOR2 INTERACTION AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2021-07-29 US disclosed
US-20210047347-A1 MODULATORS OF SESTRIN-GATOR2 INTERACTION AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2021-02-18 US disclosed
US-10912750-B2 Modulators of Sestrin-GATOR2 interaction and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2021-02-09 US disclosed
US-10752644-B2 Modulators of Sestrin-GATOR2 interaction and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2020-08-25 US disclosed
US-10414782-B2 Modulators of sestrin-GATOR2 interaction and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2019-09-17 US disclosed
US-20190048029-A1 MODULATORS OF SESTRIN-GATOR2 INTERACTION AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2019-02-14 US disclosed
US-20170114080-A1 MODULATORS OF SESTRIN-GATOR2 INTERACTION AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2017-04-27 US disclosed
US-20170114080-A1 MODULATORS OF SESTRIN-GATOR2 INTERACTION AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2017-04-27 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 (9 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-20210228523-A1 MODULATORS OF SESTRIN-GATOR2 INTERACTION AND USES THEREOF GATD3, GABRR2, GABRR3 SLC7A5 2349/4885ANPEP 4158/4885RNPEP 4677/4885
US-20170114080-A1 MODULATORS OF SESTRIN-GATOR2 INTERACTION AND USES THEREOF GATD3, GABRR2, GABRR3 SLC7A5 2349/4885ANPEP 4158/4885RNPEP 4677/4885
US-20210047347-A1 MODULATORS OF SESTRIN-GATOR2 INTERACTION AND USES THEREOF GATD3, GABRR2, GABRR3 SLC7A5 2349/4885ANPEP 4158/4885RNPEP 4677/4885
US-10912750-B2 Modulators of Sestrin-GATOR2 interaction and uses thereof GATD3, GABRR2, GABRR3 SLC7A5 2349/4885ANPEP 4158/4885RNPEP 4677/4885
US-20190048029-A1 MODULATORS OF SESTRIN-GATOR2 INTERACTION AND USES THEREOF GATD3, GABRR2, GABRR3 SLC7A5 2349/4885ANPEP 4158/4885RNPEP 4677/4885
US-11679090-B2 Modulators of Sestrin-GATOR2 interaction and uses thereof GATD3, GABRR2, GABRR3 SLC7A5 2349/4885ANPEP 4158/4885RNPEP 4677/4885
US-10752644-B2 Modulators of Sestrin-GATOR2 interaction and uses thereof GATD3, GABRR2, GABRR3 SLC7A5 2349/4885ANPEP 4158/4885RNPEP 4677/4885
US-10414782-B2 Modulators of sestrin-GATOR2 interaction and uses thereof GATD3, GABRR2, GABRR3 SLC7A5 2349/4885ANPEP 4158/4885RNPEP 4677/4885
US-11325924-B2 Modulators of Sestrin-GATOR2 interaction and uses thereof GATD3, GABRR2, GABRR3 SLC7A5 2349/4885ANPEP 4158/4885RNPEP 4677/4885

“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.