SCHEMBL11866246

SCHEMBL11866246

CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 1/20 0.44
▸ REN P00797 13/20 0.43
▸ KMT2A Q03164 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ MAPK8 P45983 1/20 0.39
▸ MAPK9 P45984 1/20 0.39
▸ MAPK10 P53779 1/20 0.39

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
SCHEMBL11866232 1.00 TGM2 (0.44) TGM2RENKMT2AL3MBTL1MAPK8
SCHEMBL30179356 0.84 KMT2A (0.51) TGM2RENKMT2AL3MBTL1
SCHEMBL30051243 0.84 KMT2A (0.51) TGM2RENKMT2AL3MBTL1
SCHEMBL30179468 0.84 KMT2A (0.51) TGM2RENKMT2AL3MBTL1
SCHEMBL30412022 0.83 TGM2 (0.46) TGM2RENMAPK8MAPK9MAPK10
SCHEMBL38658073 0.81 CALCRL (0.45) TGM2RENMAPK8MAPK9MAPK10
SCHEMBL30716931 0.80 NTSR1 (0.55) —
SCHEMBL11857309 0.80 NTSR2 (0.46) —
SCHEMBL11857288 0.80 NTSR2 (0.46) —
SCHEMBL30844257 0.80 PRMT5 (0.42) RENMAPK8MAPK9MAPK10

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
US-3947575-A Peptides as argiotensin converting enzyme inhibitors E. R. SQUIBB & SONS, INC. (US) 1976-03-30 — — US disclosed
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