SCHEMBL17019790

SCHEMBL17019790

NNC(=O)c1ccc(C(=O)O)o1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.50
KDM4E B2RXH2 4/20 0.47
GAA P10253 2/20 0.47
MAPT P10636 7/20 0.46
ALDH1A1 P00352 4/20 0.46
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MME P08473 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL11426592 0.91 KDM4E (0.53) TDP1KDM4EGAAMAPTALDH1A1
SCHEMBL38726 0.81 TDP1 (0.61) TDP1KDM4EALDH1A1POLB
SCHEMBL11904537 0.81 TDP1 (0.61) TDP1KDM4EALDH1A1POLB
Ethylenediamine SCHEMBL29057803 0.79 TDP1 (0.56) TDP1MAPTALDH1A1L3MBTL1POLB
SCHEMBL4146465 0.78 TDP1 (0.45) TDP1KDM4EGAAALDH1A1NPC1
SCHEMBL23727166 0.78 TDP1 (0.58) TDP1KDM4EALDH1A1POLB
Fluoride SCHEMBL20513066 0.78 TDP1 (0.58) TDP1ALDH1A1POLB
SCHEMBL18074260 0.78 TDP1 (0.58) TDP1KDM4EALDH1A1POLB
Fluoride SCHEMBL21331933 0.78 TDP1 (0.58) TDP1ALDH1A1POLB
Bromide SCHEMBL20513084 0.78 TDP1 (0.58) TDP1KDM4EALDH1A1POLB

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
CN-116688209-B Medical dressing, preparation method and application 江南大学 2025-06-24 CN claimed
CN-116688209-B Medical dressing, preparation method and application 江南大学 2025-06-24 CN disclosed
US-10948502-B2 Oxidized lipid detection KRATOS ANALYTICAL LIMITED (GB) 2021-03-16 US disclosed
EP-3105597-B1 OXIDIZED LIPID DETECTION KRATOS ANALYTICAL LTD (GB) 2020-11-18 EP disclosed
WO-2015121627-A1 OXIDIZED LIPID DETECTION KRATOS ANALYTICAL LIMITED (GB) 2015-08-20 WO disclosed