SCHEMBL29401229

SCHEMBL29401229

CN(C(=O)OCc1ccccc1)[C@@H](CCC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.48
ABCB1 P08183 2/20 0.46
ITGB3 P05106 2/20 0.44
ITGA2B P08514 2/20 0.44
CTSL P07711 1/20 0.42
CTSB P07858 1/20 0.42
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
SYK P43405 1/20 0.41
ALDH1A1 P00352 3/20 0.39
LTA4H P09960 1/20 0.39
MAPT P10636 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
PPARA Q07869 1/20 0.38
MAPK1 P28482 1/20 0.38
TPSAB1 Q15661 2/20 0.38
TPSD1 Q9BZJ3 2/20 0.38
TPSG1 Q9NRR2 2/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL16095584 1.00 FOLH1 (0.48) FOLH1ABCB1ITGB3ITGA2BCTSL
SCHEMBL16095581 1.00 FOLH1 (0.48) FOLH1ABCB1ITGB3ITGA2BCTSL
SCHEMBL9086697 0.93 ABCB1 (0.46) FOLH1ABCB1ITGB3ITGA2BCTSL
SCHEMBL12574290 0.91 FOLH1 (0.48) FOLH1ABCB1ITGB3ITGA2BSYK
SCHEMBL2729968 0.88 ABCB1 (0.50) FOLH1ABCB1ITGB3ITGA2BCTSL
SCHEMBL27810816 0.88 ABCB1 (0.50) FOLH1ABCB1ITGB3ITGA2BCTSL
SCHEMBL25329265 0.87 TPSAB1 (0.43) FOLH1ABCB1SYKALDH1A1LTA4H
SCHEMBL16128221 0.86 ABCB1 (0.57) FOLH1ABCB1ITGB3ITGA2BCTSL
SCHEMBL28404302 0.85 FOLH1 (0.63) FOLH1ABCB1ITGB3ITGA2BCTSL
SCHEMBL7087077 0.85 FOLH1 (0.63) FOLH1ABCB1ITGB3ITGA2BCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119954773-A PSMA compounds, pharmaceutical compositions comprising the same and uses thereof 苏州威智创科生物有限公司 2025-05-09 CN disclosed
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
CN-116829949-A Compositions for detecting or measuring analytes 伯蒂斯有限公司 2023-09-29 CN 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