SCHEMBL26199484

SCHEMBL26199484

COC(=O)[C@@H]1CCCN1C(=O)C[C@@H](C)O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PEPD P12955 2/20 0.50
▸ KLK5 Q9Y337 1/20 0.49
▸ POLB P06746 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.48
▸ XPNPEP1 Q9NQW7 1/20 0.47
▸ FKBP1A P62942 2/20 0.47
▸ RAB9A P51151 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ ACE P12821 2/20 0.44
▸ REN P00797 2/20 0.42
▸ DPP4 P27487 2/20 0.40
▸ KMT2A Q03164 1/20 0.40

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
SCHEMBL26199360 1.00 PEPD (0.50) PEPDKLK5POLBALDH1A1XPNPEP1
SCHEMBL13885358 0.89 POLB (0.50) PEPDKLK5POLBALDH1A1XPNPEP1
SCHEMBL26213384 0.89 POLB (0.50) PEPDKLK5POLBALDH1A1XPNPEP1
SCHEMBL21246655 0.83 ACE (0.60) PEPDRAB9ALMNAACEREN
SCHEMBL21246658 0.83 ACE (0.60) PEPDRAB9ALMNAACEREN
SCHEMBL21906262 0.81 PEPD (0.45) PEPDKLK5POLBALDH1A1XPNPEP1
SCHEMBL7333522 0.81 POLB (0.54) PEPDKLK5POLBALDH1A1XPNPEP1
SCHEMBL4179454 0.81 FKBP1A (0.55) PEPDKLK5POLBALDH1A1XPNPEP1
SCHEMBL7333530 0.81 POLB (0.54) PEPDKLK5POLBALDH1A1XPNPEP1
SCHEMBL13662643 0.81 FKBP1A (0.55) PEPDKLK5POLBALDH1A1XPNPEP1

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
WO-2023130008-A2 PHARMACEUTICAL COMPOSITIONS OF 6-(2-(2H-TETRAZOL-5-YL)ETHYL)DECAHYDROISOQUINOLINE-3-CARBOXYLIC ACID AND DERIVATIVES THEREOF SEA PHARMACEUTICALS LLC (US) 2023-07-06 — — WO disclosed
Send feedback