SCHEMBL20057097

SCHEMBL20057097

CC(O)C(NC(=O)NCc1nc(CN)no1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 4/20 0.43
VSIR Q9H7M9 3/20 0.43
MAPK1 P28482 2/20 0.37
TSHR P16473 1/20 0.37
PDCD1LG2 Q9BQ51 2/20 0.35
PDCD1 Q15116 1/20 0.34
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.32
CA2 P00918 1/20 0.32

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
SCHEMBL20057121 1.00 CD274 (0.43) CD274VSIRMAPK1TSHRPDCD1LG2
SCHEMBL19981346 0.89 VSIR (0.40) CD274VSIRMAPK1TSHRPDCD1LG2
SCHEMBL19981348 0.89 VSIR (0.40) CD274VSIRMAPK1TSHRPDCD1LG2
SCHEMBL24058882 0.86 ACACB (0.33) SMN1; SMN2MAPT
SCHEMBL24058548 0.84 CD274 (0.52) CD274VSIRMAPK1TSHRPDCD1LG2
SCHEMBL20057111 0.83 CD274 (0.48) CD274VSIRMAPK1TSHRPDCD1LG2
SCHEMBL20057117 0.83 CD274 (0.48) CD274VSIRMAPK1TSHRPDCD1LG2
SCHEMBL24058471 0.82 CD274 (0.47) CD274VSIRMAPK1TSHRPDCD1LG2
SCHEMBL24058469 0.82 CD274 (0.47) CD274VSIRMAPK1TSHRPDCD1LG2
SCHEMBL24058461 0.81 MAPT (0.49) MAPK1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3363790-B1 1,2,4-OXADIAZOLE DERIVATIVES AS IMMUNOMODULATORS AURIGENE DISCOVERY TECH LTD (IN) 2020-02-19 EP disclosed
EP-3041827-B1 1,2,4-OXADIAZOLE DERIVATIVES AS IMMUNOMODULATORS AURIGENE DISCOVERY TECH LTD (IN) 2018-04-18 EP disclosed