SCHEMBL20057085

SCHEMBL20057085

NC(CO)c1noc(CNC(=O)NC(CO)C(=O)O)n1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
VSIR Q9H7M9 2/20 0.43
CD274 Q9NZQ7 1/20 0.43
TGFBR1 P36897 3/20 0.35
MAPT P10636 1/20 0.34
ALDH1A1 P00352 3/20 0.32
LMNA P02545 3/20 0.32
HPGD P15428 1/20 0.32
AKR1B1 P15121 1/20 0.31
CA2 P00918 2/20 0.31
CA1 P00915 1/20 0.31
ANPEP P15144 1/20 0.30

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
SCHEMBL20057136 1.00 VSIR (0.43) VSIRCD274TGFBR1MAPTALDH1A1
SCHEMBL24058535 1.00 VSIR (0.43) VSIRCD274TGFBR1MAPTALDH1A1
SCHEMBL20057150 0.92 VSIR (0.36) VSIRCD274TGFBR1MAPTALDH1A1
SCHEMBL24595269 0.92 VSIR (0.41) VSIRCD274MAPTALDH1A1LMNA
SCHEMBL24058479 0.89 VSIR (0.43) VSIRCD274MAPTCA2CA1
SCHEMBL19969099 0.89 VSIR (0.39) VSIRCD274TGFBR1MAPTCA2
SCHEMBL24058650 0.88 FOLH1 (0.43) VSIRCD274
SCHEMBL24058460 0.88 FOLH1 (0.38) VSIRCD274MAPTCA2CA1
SCHEMBL24058693 0.88 FOLH1 (0.43) VSIRCD274
SCHEMBL24595229 0.88 FOLH1 (0.38) VSIRCD274MAPTCA2CA1

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

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