SCHEMBL81716

SCHEMBL81716

CS(=O)(=O)OC(=O)c1cccc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.52
NR4A2 P43354 1/20 0.52
NR4A3 Q92570 1/20 0.52
KMT2A Q03164 4/20 0.51
POLB P06746 2/20 0.51
GAA P10253 1/20 0.51
MEN1 O00255 3/20 0.50
MAPT P10636 3/20 0.50
PLK1 P53350 1/20 0.50
CDC25B P30305 2/20 0.49
MMP3 P08254 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
PTPN1 P18031 1/20 0.46
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 3/20 0.46
ADRB2 P07550 2/20 0.45
ADRB1 P08588 2/20 0.45
ADRB3 P13945 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45

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
SCHEMBL9255805 0.83 NR4A1 (0.52) NR4A1NR4A2NR4A3KMT2APOLB
SCHEMBL7734634 0.83 KMT2A (0.55) NR4A1NR4A2NR4A3KMT2APOLB
SCHEMBL9367082 0.79 NR4A1 (0.51) NR4A1NR4A2NR4A3KMT2APOLB
SCHEMBL9800704 0.78 LMNA (0.62) KMT2AGAAMAPTKDM4EALDH1A1
SCHEMBL522791 0.78 MAPT (0.63) NR4A1NR4A2NR4A3KMT2APOLB
SCHEMBL29580762 0.78 MAPT (0.63) NR4A1NR4A2NR4A3KMT2APOLB
SCHEMBL27259082 0.78 NR4A1 (0.59) NR4A1NR4A2NR4A3KMT2APOLB
SCHEMBL29459734 0.77 NR4A1 (0.63) NR4A1NR4A2NR4A3KMT2APOLB
SCHEMBL5987790 0.77 NR4A1 (0.63) NR4A1NR4A2NR4A3KMT2APOLB
SCHEMBL29990575 0.77 NR4A1 (0.63) NR4A1NR4A2NR4A3KMT2APOLB

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 1407 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9642846-B2 Antifungal drugs GEORGETOWN UNIVERSITY (US) 2017-05-09 US claimed
US-20160038477-A1 ANTIFUNGAL DRUGS GEORGETOWN UNIVERSITY (US) 2016-02-11 US claimed
US-20070087446-A1 Aromatic phosphonium salts and their use as labeling reagents in mass spectrometry analysis WATERS INVESTMENTS LIMITED (US) 2007-04-19 US claimed
JP-2006523845-A 2006-10-19 JP claimed
WO-2004092707-A2 AROMATIC PHOSPHONIUM SALTS AND THEIR USE AS LABELING REAGENTS MASS SPECTROMETRY ANALYSIS WATERS INVESTMENTS LIMITED (US) 2004-10-28 WO claimed
US-12043602-B2 Fendiline derivatives THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-07-23 US disclosed
US-20240239828-A1 MANNOSE 6-PHOSPHATE OR ASGPR RECEPTOR BINDING COMPOUNDS FOR THE DEGRADATION OF EXTRACELLULAR PROTEINS AVILAR THERAPEUTICS, INC. (US) 2024-07-18 US disclosed
EP-3645001-B1 MORPHIC FORMS OF GIT38 AND METHODS OF MANUFACTURE THEREOF G1 THERAPEUTICS INC (US) 2024-07-03 EP disclosed
US-12023308-B2 Agents for reversing toxic proteinopathies THE BROAD INSTITUTE, INC. (US) 2024-07-02 US disclosed
EP-4387728-A1 METHODS FOR TREATING SICKLE CELL DISEASE OR BETA THALASSEMIA USING A COMPLEMENT ALTERNATIVE PATHWAY INHIBITOR Alexion Pharmaceuticals, Inc. (US) 2024-06-26 EP disclosed
EP-4387655-A1 METHODS FOR TREATING SICKLE CELL DISEASE OR BETA THALASSEMIA USING COMPLEMENT ALTERNATIVE PATHWAY INHIBITORS Alexion Pharmaceuticals, Inc. (US) 2024-06-26 EP disclosed
US-12016834-B2 Small molecule inhibitors of SLC25A1 GEORGETOWN UNIVERSITY (US) 2024-06-25 US disclosed
WO-1998016505-A1 SULFONAMIDE INTERLEUKIN-1β CONVERTING ENZYME INHIBITORS WARNER-LAMBERT COMPANY (US) 1998-04-23 WO disclosed
WO-1998016504-A2 SULFONAMIDE SUBSTITUTED ASPARTIC ACID INTERLEUKIN-1β CONVERTING ENZYME INHIBITORS WARNER-LAMBERT COMPANY (US) 1998-04-23 WO disclosed
WO-1998016502-A1 ASPARTATE ESTER INHIBITORS OF INTERLEUKIN-1β CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 1998-04-23 WO disclosed
WO-1998009957-A1 COMPOUNDS FOR AND A METHOD OF INHIBITING MATRIX METALLOPROTEINASES WARNER-LAMBERT COMPANY (US) 1998-03-12 WO disclosed
WO-1998009934-A1 MATRIX METALLOPROTEINASE INHIBITORS AND THEIR THERAPEUTIC USES WARNER-LAMBERT COMPANY (US) 1998-03-12 WO disclosed
WO-1997045419-A1 BENZOXAZINONE DOPAMINE D4 RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1997-12-04 WO disclosed
WO-1997043307-A1 COMPOUNDS INHIBITING THE ASSOCIATION OF THE PDGF RECEPTOR AND PHOSPHATIDYLINOSITOL 3-KINASE AND THEIR USE WARNER-LAMBERT COMPANY (US) 1997-11-20 WO disclosed
WO-1997012903-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR INHIBITING THE BINDING OF PROTEINS CONTAINING AN SH2 DOMAIN TO COGNATE PHOSPHORYLATED PROTEINS WARNER-LAMBERT COMPANY (US) 1997-04-10 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 (5 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-12043602-B2 Fendiline derivatives CYP11B2, CYP3A7, CYP4F2 NR4A1 854/4885NR4A2 738/4885NR4A3 898/4885
US-20160038477-A1 ANTIFUNGAL DRUGS DPM1, ERG28, CYP51A1 NR4A1 4584/4885NR4A2 4604/4885NR4A3 4509/4885
US-20240239828-A1 MANNOSE 6-PHOSPHATE OR ASGPR RECEPTOR BINDING COMPOUNDS FOR THE DEGRADATION OF EXTRACELLULAR PROTEINS M6PR, ASGR1, IGF2R NR4A1 3266/4885NR4A2 1935/4885NR4A3 2135/4885
US-12023308-B2 Agents for reversing toxic proteinopathies MUC1, TMIGD3, TMED9 NR4A1 4242/4885NR4A2 2734/4885NR4A3 2628/4885
US-12016834-B2 Small molecule inhibitors of SLC25A1 SLC25A3, SLC2A1, SLC2A2 NR4A1 4312/4885NR4A2 2822/4885NR4A3 3236/4885

“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.