SCHEMBL11153003

SCHEMBL11153003

NC(=O)[C@@H](N)CCC(=O)NC(=O)OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 9/20 0.59
SLC1A3 P43003 1/20 0.49
SLC1A1 P43005 1/20 0.49
TSHR P16473 1/20 0.46
CA12 O43570 2/20 0.46
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA9 Q16790 2/20 0.46
CTSL P07711 1/20 0.46
HTT P42858 1/20 0.45
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL8761303 0.90 LTA4H (0.58) LTA4HSLC1A3SLC1A1CA12CA1
SCHEMBL4541364 0.90 LTA4H (0.58) LTA4HSLC1A3SLC1A1CA12CA1
SCHEMBL10421367 0.90 LTA4H (0.52) LTA4HSLC1A3SLC1A1TSHRCA12
SCHEMBL5160238 0.84 SLC1A3 (0.47) LTA4HSLC1A3SLC1A1HTTLMNA
SCHEMBL36610 0.84 SLC1A3 (0.47) LTA4HSLC1A3SLC1A1HTTLMNA
SCHEMBL11164800 0.83 LTA4H (0.56) LTA4H
SCHEMBL11803712 0.82 LTA4H (0.45) LTA4HSLC1A3SLC1A1CA12CA1
SCHEMBL10827928 0.82 CTSK (0.50) CTSLHTTLMNASMN1; SMN2
SCHEMBL8233964 0.81 LTA4H (0.55) LTA4HSLC1A3SLC1A1LMNA
SCHEMBL16917221 0.81 LTA4H (0.55) LTA4HSLC1A3SLC1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0018793-B1 PEPTIDES AND PROCESS FOR THEIR PREPARATION ORTHO PHARMACEUTICAL CORPORATION (US) 1983-11-09 EP disclosed
US-4250086-A Method and composition for preparation of H-SAR-LYS-SAR-GLN-NH2 ORTHO PHARMACEUTICAL CORPORATION (US) 1981-02-10 US disclosed
EP-0018793-A2 Peptides and process for their preparation ORTHO PHARMACEUTICAL CORPORATION (US) 1980-11-12 EP disclosed