SCHEMBL29401910

SCHEMBL29401910

O=CNCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 3/20 0.61
SIRT2 Q8IXJ6 2/20 0.61
SIRT1 Q96EB6 2/20 0.61
TGM2 P21980 11/20 0.58
ITGB3 P05106 2/20 0.57
ITGAV P06756 2/20 0.57
SIRT5 Q9NXA8 1/20 0.53
MMP2 P08253 1/20 0.53
MMP9 P14780 1/20 0.53
SIRT3 Q9NTG7 1/20 0.52

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
SCHEMBL8387978 0.89 FOLH1 (0.65) FOLH1SIRT2SIRT1TGM2ITGB3
SCHEMBL464715 0.87 FOLH1 (0.78) FOLH1SIRT2SIRT1TGM2ITGB3
SCHEMBL4561005 0.87 FOLH1 (0.78) FOLH1SIRT2SIRT1TGM2ITGB3
SCHEMBL806151 0.87 FOLH1 (0.78) FOLH1SIRT2SIRT1TGM2ITGB3
SCHEMBL12091751 0.87 FOLH1 (0.64) FOLH1SIRT2SIRT1TGM2ITGB3
SCHEMBL10421088 0.87 FOLH1 (0.62) FOLH1SIRT2SIRT1TGM2ITGB3
SCHEMBL12874103 0.86 SIRT2 (0.65) FOLH1SIRT2SIRT1TGM2ITGB3
SCHEMBL13512300 0.86 FOLH1 (0.63) FOLH1SIRT2SIRT1TGM2ITGB3
SCHEMBL12247715 0.86 SIRT2 (0.65) FOLH1SIRT2SIRT1TGM2ITGB3
SCHEMBL8058832 0.86 FOLH1 (0.57) FOLH1SIRT2SIRT1TGM2ITGB3

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