SCHEMBL22322657

SCHEMBL22322657

CC(C)(C)OC(=O)N1CCC(OS(C)(=O)=O)CC1C(=O)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KLK7 P49862 1/20 0.48
FKBP1A P62942 8/20 0.45
STS P08842 1/20 0.42
NR1H2 P55055 2/20 0.41
NR1H3 Q13133 2/20 0.41
AGTR2 P50052 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CTSL P07711 1/20 0.40
HCRTR2 O43614 1/20 0.40

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
SCHEMBL29550939 1.00 KLK7 (0.48) KLK7FKBP1ASTSNR1H2NR1H3
SCHEMBL1781452 0.90 MCL1 (0.45) KLK7FKBP1ANR1H2NR1H3
SCHEMBL1781450 0.90 MCL1 (0.45) KLK7FKBP1ANR1H2NR1H3
SCHEMBL4923969 0.90 MCL1 (0.45) KLK7FKBP1ANR1H2NR1H3
SCHEMBL28632436 0.86 FKBP1A (0.50) KLK7FKBP1AMEN1KMT2ACTSL
SCHEMBL16064974 0.86 FKBP1A (0.50) KLK7FKBP1AMEN1KMT2ACTSL
SCHEMBL29551303 0.86 FKBP1A (0.50) KLK7FKBP1AMEN1KMT2ACTSL
SCHEMBL21066263 0.85 KLK7 (0.47) KLK7FKBP1ASTSNR1H2NR1H3
SCHEMBL29447560 0.84 FKBP1A (0.58) KLK7FKBP1AMEN1KMT2ANPC1
SCHEMBL7404715 0.84 FKBP1A (0.58) KLK7FKBP1AMEN1KMT2ANPC1

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-119868377-A Combination therapy for the treatment of cancer 阿斯利康(瑞典)有限公司 2025-04-25 CN disclosed
EP-3921033-A1 ARGINASE INHIBITORS AND METHODS OF USE THEREOF AstraZeneca AB (SE) 2021-12-15 EP disclosed
CN-113395996-A Arginase inhibitors and methods of use thereof 阿斯利康(瑞典)有限公司 2021-09-14 CN disclosed
WO-2020161675-A1 ARGINASE INHIBITORS AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2020-08-13 WO disclosed