SCHEMBL25335274

SCHEMBL25335274

CC(C)(C)NCC(=O)NC(Cc1ccccc1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 8/20 0.56
▸ NPSR1 Q6W5P4 1/20 0.55
▸ MME P08473 3/20 0.53
▸ ACE2 Q9BYF1 2/20 0.53
▸ ECE1 P42892 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ CPA1 P15085 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ FAAH O00519 2/20 0.51
▸ ITGB3 P05106 1/20 0.51
▸ ITGA2B P08514 1/20 0.51
▸ LMNA P02545 1/20 0.50
▸ NAALAD2 Q9Y3Q0 1/20 0.50

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
SCHEMBL24765340 0.95 ACE (0.51) ACENPSR1MMEACE2ECE1
SCHEMBL24765356 0.95 ACE (0.51) ACENPSR1MMEACE2ECE1
SCHEMBL24764553 0.90 CTSB (0.54) ACEMMEACE2CPA1
SCHEMBL24765225 0.90 CTSB (0.54) ACEMMEACE2CPA1
SCHEMBL24765349 0.85 CTSS (0.53) ACEMMEECE1KMT2A
SCHEMBL24765350 0.85 CTSS (0.53) ACEMMEECE1KMT2A
SCHEMBL19974071 0.83 L3MBTL1 (0.60) ACENPSR1MMEACE2ECE1
SCHEMBL14456823 0.83 L3MBTL1 (0.60) ACENPSR1MMEACE2ECE1
SCHEMBL23572653 0.82 OPRD1 (0.51) ACE
SCHEMBL23572652 0.82 OPRD1 (0.51) ACE

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-2023143351-A1 DRUG CONJUGATE OF GLUCOCORTICOID 上海盛迪医药有限公司 2023-08-03 — — WO disclosed
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