SCHEMBL20649207

SCHEMBL20649207

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.39
DPP8 Q6V1X1 5/20 0.39
DPP9 Q86TI2 5/20 0.39
PDCD1LG2 Q9BQ51 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
PAX8 Q06710 1/20 0.38
SPHK1 Q9NYA1 2/20 0.36
DPP7 Q9UHL4 3/20 0.35
GLS O94925 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP9 P14780 1/20 0.34
MMP8 P22894 1/20 0.34
CA9 Q16790 1/20 0.34
SLC7A5 Q01650 1/20 0.34
TSHR P16473 1/20 0.34
SLC15A1 P46059 1/20 0.34

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
SCHEMBL23866587 1.00 DPP4 (0.39) DPP4DPP8DPP9PDCD1LG2CD274
SCHEMBL12269108 1.00 DPP4 (0.39) DPP4DPP8DPP9PDCD1LG2CD274
Hydrochloric Acid SCHEMBL29244906 0.98 DPP4 (0.38) DPP4DPP8DPP9PDCD1LG2CD274
Hydrochloric Acid SCHEMBL29244908 0.98 DPP4 (0.38) DPP4DPP8DPP9PDCD1LG2CD274
SCHEMBL10990027 0.82 PDCD1LG2 (0.37) DPP4DPP8DPP9PDCD1LG2CD274
SCHEMBL16999949 0.81 DPP9 (0.50) DPP4DPP8DPP9DPP7SLC15A1
SCHEMBL10076136 0.81 DPP9 (0.50) DPP4DPP8DPP9DPP7SLC15A1
SCHEMBL24221417 0.81 DPP9 (0.49) DPP4DPP8DPP9DPP7CA12
SCHEMBL5841680 0.80 MME (0.47) DPP4DPP8DPP9PDCD1LG2CD274
SCHEMBL23030200 0.80 MME (0.47) DPP4DPP8DPP9PDCD1LG2CD274

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-20220112158-A1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDES AND PROTEIN CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. 2022-04-14 US disclosed
US-20220002242-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2022-01-06 US disclosed
US-10961189-B2 Spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2021-03-30 US disclosed
US-20190161442-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2019-05-30 US disclosed
WO-2019013789-A1 ANTIMICROBIAL COMPOUNDS CURZA GLOBAL, LLC (US) 2019-01-17 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 (4 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-20190161442-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A DPP4 2195/4885DPP8 1501/4885DPP9 2104/4885
US-10961189-B2 Spiro-lactam NMDA receptor modulators and uses thereof GRIN1, GRIN2A, GRIN3A DPP4 2195/4885DPP8 1501/4885DPP9 2104/4885
US-20220112158-A1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDES AND PROTEIN CONJUGATES THEREOF NR1H4, NR1H3, OGFR DPP4 2467/4885DPP8 1194/4885DPP9 1582/4885
US-20220002242-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A DPP4 2195/4885DPP8 1501/4885DPP9 2104/4885

“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.