SCHEMBL2564034

SCHEMBL2564034

NNC(=O)c1ccccc1ON

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSD P07339 2/20 0.70
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
ALDH1A1 P00352 2/20 0.49
HCRTR1 O43613 2/20 0.46
MITF O75030 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
NCOA1 Q15788 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NCOA3 Q9Y6Q9 1/20 0.46
P2RX7 Q99572 1/20 0.44
HPGD P15428 2/20 0.44
LIG1 P18858 1/20 0.44
TP53 P04637 1/20 0.44
GLA P06280 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL4915367 0.86 CTSD (0.68) CTSDMEN1KMT2ACA1CA2
SCHEMBL6329484 0.86 CTSD (0.72) CTSDMEN1KMT2ACA1CA2
SCHEMBL295407 0.82 CTSD (1.00) CTSDMEN1KMT2AALDH1A1GAA
SCHEMBL7748621 0.82 CTSD (0.68) CTSDMEN1KMT2ACA1CA2
SCHEMBL16193193 0.82 CTSD (0.68) CTSDMEN1KMT2ACA1CA2
SCHEMBL30349208 0.82 CTSD (1.00) CTSDMEN1KMT2AALDH1A1GAA
SCHEMBL11326953 0.81 CTSD (0.66) CTSDMEN1KMT2ACA1CA2
SCHEMBL17479848 0.81 CTSD (0.66) CTSDMEN1KMT2ACA1CA2
SCHEMBL239328 0.80 CTSD (0.63) CTSDMEN1KMT2ACA1CA2
SCHEMBL30547074 0.80 CTSD (0.63) CTSDMEN1KMT2ACA1CA2

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-115666653-A Antibody-drug conjugates 斯皮雷亚有限公司 2023-01-31 CN disclosed
CN-113226378-A Antibody-drug conjugates 斯皮雷亚有限公司 2021-08-06 CN disclosed
EP-2560634-A1 NITRIC OXIDE RELEASING PRODRUGS OF THERAPEUTIC AGENTS Piramal Enterprises Limited (IN) 2013-02-27 EP disclosed
WO-2011132171-A1 NITRIC OXIDE RELEASING PRODRUGS OF THERAPEUTIC AGENTS PIRAMAL LIFE SCIENCES LIMITED (IN) 2011-10-27 WO disclosed