SCHEMBL23201200

SCHEMBL23201200

CC(C)(C)OC(=O)NC(C(=O)C[C@H](N)C(=O)O)C1Cc2ccccc2C1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACE P12821 1/20 0.41
CTSL P07711 2/20 0.40
PPARA Q07869 5/20 0.39
PPARG P37231 4/20 0.39
IDO1 P14902 1/20 0.39
CTSS P25774 3/20 0.39
CTSK P43235 2/20 0.39
ATM Q13315 1/20 0.39
AAK1 Q2M2I8 1/20 0.39
PPARD Q03181 2/20 0.38
CTSB P07858 1/20 0.38
EPHX2 P34913 1/20 0.37
SLC7A5 Q01650 1/20 0.37
SCN9A Q15858 1/20 0.37
CXCR3 P49682 1/20 0.37

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
SCHEMBL1598690 0.84 EPHX2 (0.44) ACECTSLPPARAPPARGIDO1
SCHEMBL4816579 0.84 EPHX2 (0.44) ACECTSLPPARAPPARGIDO1
SCHEMBL5389519 0.84 EPHX2 (0.44) ACECTSLPPARAPPARGIDO1
SCHEMBL29911641 0.84 EPHX2 (0.44) ACECTSLPPARAPPARGIDO1
SCHEMBL23201197 0.78 AAK1 (0.43) CTSLPPARAPPARGIDO1CTSS
SCHEMBL23201199 0.78 AAK1 (0.43) CTSLPPARAPPARGIDO1CTSS
SCHEMBL30882362 0.78 AAK1 (0.43) CTSLPPARAPPARGIDO1CTSS
SCHEMBL28584296 0.74 CTSK (0.64) ACECTSLPPARAPPARGCTSS
SCHEMBL239019 0.72 GRM7 (0.40) EPHX2
SCHEMBL27923521 0.72 GRM7 (0.40) EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117964684-A MASP-2 inhibitors and methods of use 奥默罗斯公司 2024-05-03 CN disclosed
CN-117964683-A MASP-2 inhibitors and methods of use 奥默罗斯公司 2024-05-03 CN disclosed
CN-112867706-A MASP-2 inhibitors and methods of use 奥默罗斯公司 2021-05-28 CN disclosed
EP-3802489-A2 MASP-2 INHIBITORS AND METHODS OF USE Omeros Corporation (US) 2021-04-14 EP disclosed