SCHEMBL20123209

SCHEMBL20123209

COOC(=O)N[C@@H](C)CN

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDCD1LG2 Q9BQ51 2/20 0.37
CD274 Q9NZQ7 2/20 0.37
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MEN1 O00255 1/20 0.31
TSHR P16473 1/20 0.31
KMT2A Q03164 1/20 0.31
MGAM O43451 1/20 0.30
GAA P10253 1/20 0.30
SI P14410 1/20 0.30
MGAM2 Q2M2H8 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
SCHEMBL30356501 0.85
SCHEMBL8220160 0.85
SCHEMBL68680 0.85
Hydrochloric Acid SCHEMBL1494455 0.83 ACACB (0.36) PDCD1LG2CD274MMP1MMP2MMP3
Hydrochloric Acid SCHEMBL1494453 0.83 ACACB (0.36) PDCD1LG2CD274MMP1MMP2MMP3
SCHEMBL68755 0.77 ALOX15 (0.38) PDCD1LG2CD274SMN1; SMN2TSHR
SCHEMBL20733126 0.75 PDCD1LG2 (0.32) PDCD1LG2CD274TSHR
SCHEMBL31098914 0.75
SCHEMBL68393 0.73 SMN1; SMN2 (0.49) PDCD1LG2CD274SMN1; SMN2TSHR
SCHEMBL84553 0.73 CA2 (0.53) MEN1KMT2AGAA

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-2749566-B1 SOLID-PHASE CARRIER FOR AMINATED OLIGONUCLEOTIDE AIST (JP) 2018-05-09 EP disclosed