SCHEMBL6719263

SCHEMBL6719263

Cc1ccccc1NC(=O)C(N)Cc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.63
HPGD P15428 2/20 0.56
ALDH1A1 P00352 1/20 0.53
ALPI P09923 1/20 0.53
PKM P14618 1/20 0.53
PTGS1 P23219 1/20 0.53
XIAP P98170 1/20 0.53
SLC7A5 Q01650 1/20 0.53
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
MAPT P10636 2/20 0.52
ITGB3 P05106 1/20 0.51
ITGB1 P05556 1/20 0.51
ITGAV P06756 1/20 0.51
ITGA5 P08648 1/20 0.51
KMT2A Q03164 2/20 0.51
CTSC P53634 1/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
SLC15A1 P46059 1/20 0.50

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
SCHEMBL28277701 1.00 POLB (0.63) POLBHPGDALDH1A1ALPIPKM
Formic Acid SCHEMBL6714418 0.94 POLB (0.57) POLBHPGDALDH1A1ALPIPKM
SCHEMBL28085732 0.86 THRB (0.66) POLBALDH1A1MAPTKMT2AMEN1
SCHEMBL28085741 0.86 THRB (0.55) POLBALDH1A1NPC1RAB9AKMT2A
SCHEMBL8338540 0.84 HDAC3 (0.60) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL30453415 0.84 TP53 (0.57) POLBALDH1A1NPC1RAB9AMAPT
SCHEMBL28707611 0.83 NPC1 (0.55) POLBHPGDALDH1A1NPC1RAB9A
SCHEMBL29410404 0.83 NPC1 (0.55) POLBHPGDALDH1A1NPC1RAB9A
SCHEMBL26741101 0.83 PGR (0.57) POLBHPGDALDH1A1NPC1RAB9A
SCHEMBL26741100 0.83 PGR (0.57) POLBHPGDALDH1A1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112601734-B Oximino naphthoquinone compound and preparation method and application thereof 普济生物科技(台州)有限公司 2023-05-23 CN disclosed
CN-112601734-A Oximido naphthoquinone compound and preparation method and application thereof 普济生物科技(台州)有限公司 2021-04-02 CN disclosed
CN-109438277-A Oximido naphthoquinone compound and its preparation method and application 普济生物科技(台州)有限公司 2019-03-08 CN disclosed
US-20040152740-A1 Arylglycine derivatives for use as glycine transport inhibitors NPS ALLELIX CORPORATION (CA) 2004-08-05 US disclosed
WO-2004022534-A1 ARYLGLYCINE DERIVATIVES FOR USE AS GLYCINE TRANSPORT INHIBITORS NPS ALLELIX CORP. (CA) 2004-03-18 WO disclosed
WO-2004022534-A1 ARYLGLYCINE DERIVATIVES FOR USE AS GLYCINE TRANSPORT INHIBITORS NPS ALLELIX CORP. (CA) 2004-03-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040152740-A1 Arylglycine derivatives for use as glycine transport inhibitors SLC1A2, SLC6A7, SLC1A1 POLB 4182/4885HPGD 619/4885ALDH1A1 572/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.