SCHEMBL10705141

SCHEMBL10705141

N[C@H](CNC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 2/20 0.65
SLC1A3 P43003 1/20 0.65
LMNA P02545 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
HTT P42858 1/20 0.54
CA12 O43570 2/20 0.51
CA1 P00915 2/20 0.51
CA2 P00918 2/20 0.51
CA9 Q16790 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
PLAU P00749 1/20 0.50
DPP8 Q6V1X1 1/20 0.50
DPP7 Q9UHL4 1/20 0.50
ALPI P09923 1/20 0.50
PKM P14618 1/20 0.50
PTGS1 P23219 1/20 0.50
XIAP P98170 1/20 0.50
SLC7A5 Q01650 1/20 0.50
SYK P43405 1/20 0.49
SLC6A2 P23975 1/20 0.49

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
SCHEMBL7375139 1.00 SLC1A1 (0.65) SLC1A1SLC1A3LMNASMN1; SMN2HTT
SCHEMBL542279 1.00 SLC1A1 (0.65) SLC1A1SLC1A3LMNASMN1; SMN2HTT
Hydrochloric Acid SCHEMBL383365 0.98 SLC1A1 (0.64) SLC1A1SLC1A3LMNASMN1; SMN2HTT
Hydrochloric Acid SCHEMBL7355918 0.98 SLC1A1 (0.64) SLC1A1SLC1A3LMNASMN1; SMN2HTT
SCHEMBL29398484 0.91 SLC1A3 (0.58) SLC1A1SLC1A3LMNASMN1; SMN2HTT
SCHEMBL14381151 0.89 SLC1A3 (0.56) SLC1A1SLC1A3LMNASMN1; SMN2HTT
SCHEMBL14335621 0.88 SLC1A3 (0.55) SLC1A1SLC1A3LMNASMN1; SMN2HTT
SCHEMBL7243772 0.88 SLC1A3 (0.55) SLC1A1SLC1A3LMNASMN1; SMN2HTT
SCHEMBL5019077 0.87 LMNA (0.59) SLC1A1SLC1A3LMNASMN1; SMN2HTT
Hydrochloric Acid SCHEMBL7243767 0.87 SLC1A3 (0.54) SLC1A1SLC1A3LMNASMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0126974-B1 CARBOXYALKYL PEPTIDE DERIVATIVES G.D. Searle & Co. (US) 1988-06-15 EP disclosed
US-4568666-A COLLAGENASE INHIBITORS, ANTIARTJRITIC AGENTS G. D. SEARLE & CO. (US) 1986-02-04 US disclosed
US-4511504-A COLLAGENASE INHIBITORS G.D. SEARLE & CO. (US) 1985-04-16 US disclosed
EP-0126974-A1 Carboxyalkyl peptide derivatives G.D. Searle & Co. (US) 1984-12-05 EP disclosed