SCHEMBL20917138

SCHEMBL20917138

O=C(O)c1cccn1-c1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 6/20 0.50
TDP1 Q9NUW8 4/20 0.50
L3MBTL1 Q9Y468 4/20 0.50
APEX1 P27695 2/20 0.50
GPX4 P36969 1/20 0.49
ALOX15 P16050 2/20 0.42
TSHR P16473 1/20 0.42
RECQL P46063 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
CACNA1B Q00975 2/20 0.41
APBA1 Q02410 2/20 0.41
MCL1 Q07820 2/20 0.41
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
NSD2 O96028 1/20 0.41
THRB P10828 1/20 0.41
PKM P14618 1/20 0.41
TNNI3 P19429 1/20 0.41
PTPN7 P35236 1/20 0.41

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
SCHEMBL4787559 0.84 POLB (0.61) POLBTDP1L3MBTL1APEX1TSHR
SCHEMBL7630480 0.81 RECQL (0.57) POLBTDP1L3MBTL1APEX1TSHR
SCHEMBL6052408 0.81 TDP1 (0.50) POLBTDP1L3MBTL1APEX1MEN1
SCHEMBL15058294 0.81 POLB (0.50) POLBTDP1L3MBTL1APEX1RECQL
SCHEMBL4960652 0.79 POLB (0.47) POLBTDP1L3MBTL1APEX1TSHR
SCHEMBL29797575 0.78 POLB (0.49) POLBTDP1L3MBTL1APEX1
SCHEMBL4543597 0.78 POLB (0.41) POLBTDP1L3MBTL1APEX1GPX4
SCHEMBL4540045 0.78 L3MBTL1 (0.50) POLBTDP1L3MBTL1APEX1RECQL
SCHEMBL7631926 0.77 POLB (0.46) POLBTDP1L3MBTL1APEX1TSHR
SCHEMBL1494699 0.77 ALDH1A1 (0.55) POLBTDP1L3MBTL1APEX1GPX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3697763-A1 D-AMINO ACID OXIDASE INHIBITORS AND THERAPEUTIC USES THEREOF Syneurx International (Taiwan) Corp. (TW) 2020-08-26 EP disclosed
WO-2019076329-A9 D-AMINO ACID OXIDASE INHIBITORS AND THERAPEUTIC USES THEREOF TSAI GUOCHUAN EMIL (CN) 2019-08-15 WO disclosed
WO-2019076329-A1 D-AMINO ACID OXIDASE INHIBITORS AND THERAPEUTIC USES THEREOF TSAI GUOCHUAN EMIL (CN) 2019-04-25 WO disclosed