SCHEMBL28819863

SCHEMBL28819863

CC(NC(=O)OCc1ccccc1)C(=O)NC(CC(N)=O)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.60
ECE1 P42892 2/20 0.60
CTSK P43235 3/20 0.57
PSMB1 P20618 1/20 0.53
LGMN Q99538 3/20 0.52
CAPN1 P07384 2/20 0.51
TPSAB1 Q15661 2/20 0.50
PSMB8 P28062 2/20 0.50
PSMB5 P28074 2/20 0.50
PLG P00747 1/20 0.50
PRSS1 P07477 1/20 0.50
PSMB9 P28065 1/20 0.50
REN P00797 1/20 0.49

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
SCHEMBL28645693 1.00 MME (0.60) MMEECE1CTSKPSMB1LGMN
SCHEMBL19384748 0.99 MME (0.59) MMEECE1CTSKPSMB1LGMN
SCHEMBL14371944 0.99 MME (0.59) MMEECE1CTSKPSMB1LGMN
SCHEMBL20263591 0.99 MME (0.59) MMEECE1CTSKPSMB1LGMN
SCHEMBL20677213 0.99 MME (0.59) MMEECE1CTSKPSMB1LGMN
SCHEMBL24992811 0.99 MME (0.59) MMEECE1CTSKPSMB1LGMN
SCHEMBL21523353 0.93 MME (0.55) MMEECE1CTSKPSMB1LGMN
SCHEMBL21523352 0.93 MME (0.55) MMEECE1CTSKPSMB1LGMN
SCHEMBL20323161 0.93 MME (0.55) MMEECE1CTSKPSMB1LGMN
SCHEMBL20287884 0.91 MME (0.52) MMEECE1CTSKPSMB1LGMN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116059390-A Prodrugs of cytotoxic actives with enzymatically cleavable groups 拜耳制药股份公司 2023-05-05 CN disclosed
CN-114917361-A Antibody Drug Conjugates (ADC) and antibody prodrug conjugates (APDC) with enzyme cleavable groups 拜耳医药股份有限公司 2022-08-19 CN disclosed