SCHEMBL29398348

SCHEMBL29398348

CC(=O)N[C@H](Cc1ccc(OC(C)(C)C)cc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 4/20 0.61
▸ ITGB3 P05106 3/20 0.60
▸ ITGA2B P08514 3/20 0.60
▸ LMNA P02545 1/20 0.53
▸ FPR2 P25090 2/20 0.49
▸ ACE P12821 4/20 0.49
▸ MME P08473 3/20 0.49
▸ ACE2 Q9BYF1 3/20 0.49
▸ PPARG P37231 3/20 0.48
▸ KDM4E B2RXH2 1/20 0.47
▸ KDM4A O75164 1/20 0.47
▸ ABCB1 P08183 1/20 0.47
▸ KMT2A Q03164 1/20 0.46
▸ CPA1 P15085 2/20 0.45

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
SCHEMBL29401256 1.00 ACACB (0.61) ACACBITGB3ITGA2BLMNAFPR2
SCHEMBL14606874 0.90 ACACB (0.62) ACACBITGB3ITGA2BLMNAABCB1
SCHEMBL30658624 0.89 CTSL (0.55) ACACBITGB3ITGA2BACEMME
SCHEMBL6781722 0.87 FPR2 (0.64) ACACBITGB3ITGA2BLMNAFPR2
SCHEMBL4378290 0.87 FPR2 (0.64) ACACBITGB3ITGA2BLMNAFPR2
SCHEMBL27569374 0.87 ITGB3 (0.56) ACACBITGB3ITGA2BFPR2ACE
SCHEMBL27569376 0.87 ITGB3 (0.56) ACACBITGB3ITGA2BFPR2ACE
SCHEMBL5065823 0.86 ITGB3 (0.67) ITGB3ITGA2BACEPPARGABCB1
SCHEMBL1062486 0.86 ITGB3 (0.67) ITGB3ITGA2BACEPPARGABCB1
SCHEMBL1311509 0.86 ITGB3 (0.67) ITGB3ITGA2BACEPPARGABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4425181-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE Bertis Inc (KR) 2024-09-04 — — EP disclosed
US-20240011979-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTES BERTIS INC. (KR) 2024-01-11 — — US disclosed
WO-2023075435-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE 주식회사 베르티스 2023-05-04 — — WO disclosed
US-20220283131-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTES BERTIS CO., LTD. (KR) 2022-09-08 — — US disclosed
WO-2022050529-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE ㈜베르티스 2022-03-10 — — WO disclosed
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