SCHEMBL824375

SCHEMBL824375

c1ccc2oc(-c3nc4ccccc4o3)nc2c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.69
ALDH1A1 P00352 7/20 0.69
RAB9A P51151 6/20 0.69
HSD17B10 Q99714 5/20 0.69
HPGD P15428 5/20 0.69
TP53 P04637 5/20 0.69
MAPT P10636 5/20 0.69
SMN1; SMN2 Q16637 5/20 0.69
KDM4E B2RXH2 4/20 0.69
MEN1 O00255 3/20 0.69
KMT2A Q03164 3/20 0.69
PKM P14618 3/20 0.69
HCRTR1 O43613 1/20 0.69
CYP1A2 P05177 1/20 0.69
CYP2C9 P11712 1/20 0.69
CYP2C19 P33261 1/20 0.69
ATM Q13315 1/20 0.67
ALOX5 P09917 1/20 0.67
GAA P10253 2/20 0.58
GLA P06280 1/20 0.58

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
SCHEMBL29531707 1.00 NPC1 (0.69) NPC1ALDH1A1RAB9AHSD17B10HPGD
SCHEMBL29504749 0.91 TOP2A (0.62) NPC1ALDH1A1RAB9AHSD17B10HPGD
Anthracene SCHEMBL29003509 0.91 NPC1 (0.66) NPC1ALDH1A1RAB9AHSD17B10HPGD
SCHEMBL171055 0.91 TOP2A (0.62) NPC1ALDH1A1RAB9AHSD17B10HPGD
SCHEMBL21674121 0.91 NPC1 (0.63) NPC1ALDH1A1RAB9AHSD17B10HPGD
SCHEMBL31170 0.91 NPC1 (0.81) NPC1ALDH1A1RAB9AHSD17B10HPGD
SCHEMBL23079834 0.89 NPC1 (0.61) NPC1ALDH1A1RAB9AHSD17B10HPGD
SCHEMBL17562381 0.89 ALOX5 (0.67) NPC1ALDH1A1RAB9AHSD17B10HPGD
SCHEMBL31476 0.89 NPC1 (0.79) NPC1ALDH1A1RAB9AHSD17B10HPGD
SCHEMBL12854009 0.89 TOP2A (0.60) NPC1ALDH1A1RAB9AHSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8142863-B2 Color liquid crystal display and compensation panel Crysoptix, KK (JP) 2012-03-27 US claimed
EP-2291703-A2 COLOR LIQUID CRYSTAL DISPLAY AND COMPENSATION PANEL CRYSOPTIX K.K. (JP) 2011-03-09 EP claimed
US-20100279122-A1 Benzimidazole, Benzoxazole and Benzothiazole Derivatives, Optical Film Comprising them and Method of Producing thereof CRYSOPTIX KK (JP) 2010-11-04 US claimed
US-7659026-B2 membrane electrodes; electrocatalysts; fuel cells E.I. DU PONT DE NEMOURS AND COMPANY (US) 2010-02-09 US claimed
US-20090268136-A1 Color Liquid Crystal Display and Compensation Panel CRYSOPTIX KK (JP) 2009-10-29 US claimed
WO-2009130676-A2 COLOR LIQUID CRYSTAL DISPLAY AND COMPENSATION PANEL CRYSOPTIX KK (JP) 2009-10-29 WO claimed
EP-2081913-A2 BENZIMIDAZOLE,BENZOXAZOLE AND BENZOTHIAZOLE DERIVATIVES, OPTICAL FILM COMPRISING THEM AND METHOD OF PRODUCTION THEREOF CRYSOPTIX K.K. (JP) 2009-07-29 EP claimed
WO-2008020211-A2 BENZIMIDAZOLE, BENZOXAZOLE AND BENZOTHIAZOLE DERIVATIVES, OPTICAL FILM COMPRISING THEM AND METHOD OF PRODUCTION THEREOF CRYSOPTIX K.K. (JP) 2008-02-21 WO claimed
JP-2007528843-A 2007-10-18 JP claimed
US-20060178411-A1 Sulfonimide containing compounds and their use in polymer electrolyte membranes for electrochemical cells E. I. DU PONT DE NEMOURS AND COMPANY 2006-08-10 US claimed
US-20060177717-A1 Fluorinated sulfonamide compounds and polymer electrolyte membranes prepared therefrom for use in electrochemical cells U.S. DEPARTMENT OF ENERGY 2006-08-10 US claimed
WO-2005003081-A2 SULFONIMIDE CONTAINING COMPOUNDS AND THEIR USE IN POLYMER ELECTROLYTE MEMBRANES FOR ELECTROCHEMICAL CELLS E.I. DUPONT DE NEMOURS AND COMPANY (US) 2005-01-13 WO claimed
WO-2005001979-A2 FLUORINATED SULFONAMIDE COMPOUNDS AND POLYMER ELECTROLYTE MEMBRANES PEPARED THEREFROM FOR USE IN ELECTROCHEMICAL CELLS E.I. DUPONT DE NEMOURS AND COMPANY (US) 2005-01-06 WO claimed
US-5571874-A AZOLE POLYMER, THIAZOLE RING CLOSURE, POLYAMIDE MATRIX HONDA GIKEN KOGYO KABUSHIKI KAISHA (JP) 1996-11-05 US claimed
US-4142037-A USEFUL IN AEROSPACE APPLICATIONS SUCH AS SEALS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 1979-02-27 US claimed
CN-219215607-U Full-automatic filling and tail sealing machine for bifonazole cream 武汉润欣科技股份有限公司 2023-06-20 CN disclosed
CN-115974805-A Anthracene compound 烟台显华化工科技有限公司 2023-04-18 CN disclosed
US-4115367-A ELASTOMERS, THERMAL AND HYDROLYTIC STABILITY THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 1978-09-19 US disclosed
US-4064109-A SEALS, SEALANTS, THERMOOXIDATIVE AND HYDROLYTIC STABILITY THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 1977-12-20 US disclosed
US-4053498-A PERFLUOROALKYLENE ETHER-IMIDATE AND -THIOIMIDATE ESTERS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 1977-10-11 US 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 (3 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-20060178411-A1 Sulfonimide containing compounds and their use in polymer electrolyte membranes for electrochemical cells HCN2, KCNN2, NHERF1 NPC1 1092/4885ALDH1A1 3591/4885RAB9A 442/4885
US-20060177717-A1 Fluorinated sulfonamide compounds and polymer electrolyte membranes prepared therefrom for use in electrochemical cells PEF1, NHERF1, PXMP4 NPC1 741/4885ALDH1A1 3230/4885RAB9A 1865/4885
US-20100279122-A1 Benzimidazole, Benzoxazole and Benzothiazole Derivatives, Optical Film Comprising them and Method of Producing thereof BMX, ABCG2, BRI3BP NPC1 3022/4885ALDH1A1 1696/4885RAB9A 2720/4885

“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.