SCHEMBL2599178

SCHEMBL2599178

Nc1ccc2c(c1)C(=O)C(=O)c1ccccc1-2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 10/20 1.00
NPC1 O15118 4/20 1.00
RAB9A P51151 4/20 1.00
SMN1; SMN2 Q16637 4/20 1.00
S100A4 P26447 4/20 1.00
MEN1 O00255 4/20 1.00
KMT2A Q03164 4/20 1.00
APAF1 O14727 3/20 1.00
LMNA P02545 3/20 1.00
HTT P42858 3/20 1.00
GALK1 P51570 3/20 1.00
BLM P54132 3/20 1.00
NPSR1 Q6W5P4 3/20 1.00
ALDH1A1 P00352 2/20 1.00
TDP2 O95551 2/20 1.00
PLA2G1B P04054 2/20 1.00
POLB P06746 2/20 1.00
PLCG1 P19174 2/20 1.00
PPARG P37231 2/20 1.00
ATG4B Q9Y4P1 2/20 1.00

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
SCHEMBL30043508 1.00 PTPRC (1.00) PTPRCNPC1RAB9ASMN1; SMN2S100A4
SCHEMBL30482647 0.95 NPC1 (0.95) PTPRCNPC1RAB9ASMN1; SMN2S100A4
SCHEMBL760965 0.95 NPC1 (0.95) PTPRCNPC1RAB9ASMN1; SMN2S100A4
SCHEMBL6262683 0.95 PTPRC (1.00) PTPRCNPC1RAB9ASMN1; SMN2S100A4
SCHEMBL31615519 0.95 NPC1 (0.95) PTPRCNPC1RAB9ASMN1; SMN2S100A4
Anthraquinone SCHEMBL23363689 0.93 NPC1 (1.00) PTPRCNPC1RAB9ASMN1; SMN2S100A4
SCHEMBL40960 0.93 NPC1 (1.00) PTPRCNPC1RAB9ASMN1; SMN2S100A4
SCHEMBL31290097 0.93 NPC1 (1.00) PTPRCNPC1RAB9ASMN1; SMN2S100A4
SCHEMBL1143226 0.91 PTPRC (0.91) PTPRCNPC1RAB9ASMN1; SMN2S100A4
Benzene SCHEMBL28832927 0.91 NPC1 (0.95) PTPRCNPC1RAB9ASMN1; SMN2S100A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023285654-A2 COMPOUNDS FOR THE TREATMENT OF COVID-19 DOMPE' FARMACEUTICI SPA (IT) 2023-01-19 WO claimed
EP-4119145-A1 COMPOUNDS FOR THE TREATMENT OF COVID-19 Dompe' Farmaceutici S.P.A. (IT) 2023-01-18 EP claimed
US-20130090355-A1 CHEMICAL AGENTS FOR THE PREVENTION OF INHIBITION OR TUMOR METASTASIS ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 2013-04-11 US claimed
WO-2011146101-A1 CHEMICAL AGENTS FOR THE PREVENTION OR INHIBITION OF TUMOR METASTASIS ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 2011-11-24 WO claimed
US-20030207812-A1 Cd45 inhibitors ASTRAZENECA AB (SE) 2003-11-06 US claimed
JP-2003518085-A 2003-06-03 JP claimed
EP-1242363-A2 CD45 INHIBITORS AstraZeneca AB (SE) 2002-09-25 EP claimed
WO-2001046125-A2 CD45 INHIBITORS ASTRAZENECA AB (SE) 2001-06-28 WO claimed
US-20250213601-A1 METHODS AND BIOAVAILABLE HIGHLY PERMEABLE COMPOUNDS FOR THE TREATMENT OF VIRAL DISEASES Didenko, Kirill (US) 2025-07-03 US disclosed
WO-2023187599-A1 METHODS AND BIOAVAILABLE HIGHLY PERMEABLE COMPOUNDS FOR THE TREATMENT OF VIRAL DISEASES DIDENKO KIRILL (MX) 2023-10-05 WO disclosed
WO-2023285654-A2 COMPOUNDS FOR THE TREATMENT OF COVID-19 DOMPE' FARMACEUTICI SPA (IT) 2023-01-19 WO disclosed
EP-4119145-A1 COMPOUNDS FOR THE TREATMENT OF COVID-19 Dompe' Farmaceutici S.P.A. (IT) 2023-01-18 EP disclosed
EP-4119145-A1 COMPOUNDS FOR THE TREATMENT OF COVID-19 Dompe' Farmaceutici S.P.A. (IT) 2023-01-18 EP disclosed
US-20220001015-A1 LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS SEAPORT THERAPEUTICS, INC. 2022-01-06 US disclosed
US-5858571-A TREATING A PULVERIZED HYDROGEN ABSORBING ALLOY WITH A SOLUTION COMPRISING A CONJUGATED UNSATURATED COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-01-12 US disclosed
EP-0872903-A1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder Shin-Etsu Chemical Co., Ltd. (JP) 1998-10-21 EP disclosed
EP-0172427-B1 PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER Shin-Etsu Chemical Co., Ltd. (JP) 1989-07-05 EP disclosed
US-4758639-A Process for production of vinyl polymer SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-19 US disclosed
US-4757124-A Suspension or emulsion polymerizing vinyl chloride monomer or mixture of vinyl chloride with vinyl monomer copolymerizable therewith in reactor with walls coated with antiscaling compound containing dye or pigments SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-12 US disclosed
EP-0172427-A2 Process for production of vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1986-02-26 EP 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 (4 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-20220001015-A1 LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS LIPA, MALT1, SGMS1 PTPRC 163/4885NPC1 57/4885RAB9A 1988/4885
US-20030207812-A1 Cd45 inhibitors CD74, CD2, PTPRC PTPRC 3/4885NPC1 3699/4885RAB9A 1987/4885
US-20130090355-A1 CHEMICAL AGENTS FOR THE PREVENTION OF INHIBITION OR TUMOR METASTASIS S100A4, S100A6, S100A10 PTPRC 507/4885NPC1 4286/4885RAB9A 1861/4885
US-20250213601-A1 METHODS AND BIOAVAILABLE HIGHLY PERMEABLE COMPOUNDS FOR THE TREATMENT OF VIRAL DISEASES ACE2, FURIN, SARS1 PTPRC 2412/4885NPC1 23/4885RAB9A 1443/4885

“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.