SCHEMBL5032926

SCHEMBL5032926

Oc1ccc(-c2cc3ccccc3o2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.70
ESR2 Q92731 2/20 0.70
SHBG P04278 1/20 0.70
ALOX5 P09917 1/20 0.69
MAOB P27338 2/20 0.68
NPC1 O15118 4/20 0.60
RAB9A P51151 4/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
ALDH1A1 P00352 2/20 0.60
KDM4E B2RXH2 2/20 0.60
TDP1 Q9NUW8 2/20 0.60
HPGD P15428 2/20 0.60
GAPDH P04406 1/20 0.60
GAA P10253 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
TNKS O95271 1/20 0.60
BCHE P06276 1/20 0.60
POLB P06746 1/20 0.60
ACHE P22303 1/20 0.60
CA1 P00915 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
SCHEMBL4796576 0.98 ESR1 (0.68) ESR1ESR2SHBGALOX5MAOB
SCHEMBL4659168 0.88 MAOB (0.78) ESR1ESR2SHBGALOX5MAOB
SCHEMBL5432580 0.86 ALOX5 (0.66) ESR1ESR2SHBGALOX5MAOB
Stemofuran A SCHEMBL29742935 0.85 TYR (0.68) ESR1ESR2SHBGALOX5MAOB
Stemofuran A SCHEMBL28792809 0.85 TYR (0.68) ESR1ESR2SHBGALOX5MAOB
SCHEMBL5768216 0.84 MAOB (0.72) ALOX5MAOBNPC1RAB9ASMN1; SMN2
SCHEMBL731363 0.84 MAOB (0.71) ALOX5MAOBNPC1RAB9ASMN1; SMN2
SCHEMBL31105656 0.84 MAOB (0.71) ALOX5MAOBNPC1RAB9ASMN1; SMN2
SCHEMBL29941531 0.82 ESR1 (1.00) ESR1ESR2SHBGMAOBNPC1
SCHEMBL9138143 0.82 SHBG (1.00) ESR1ESR2SHBGALOX5MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11384060-B2 Amide compounds and use thereof ALPHALA CO., LTD. (TW) 2022-07-12 US disclosed
US-11384060-B2 Amide compounds and use thereof ALPHALA CO., LTD. (TW) 2022-07-12 US disclosed
US-20200255572-A1 THERMOPLASTIC POLYMERS SYNTHESIZED FROM DEPOLYMERIZED LIGNIN VIA FREE RADICAL POLYMERIZATION IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2020-08-13 US disclosed
US-20190337915-A1 AMIDE COMPOUNDS AND USE THEREOF ALPHALA CO., LTD. (TW) 2019-11-07 US disclosed
US-20190337915-A1 AMIDE COMPOUNDS AND USE THEREOF ALPHALA CO., LTD. (TW) 2019-11-07 US disclosed
WO-2018140339-A1 AMIDE COMPOUNDS AND USE THEREOF ALPHALA CO., LTD. (TW) 2018-08-02 WO disclosed
CN-107698571-A Naphthalimide-coumarin DNA targeting double-intercalator, synthesis and application thereof 大连理工大学 2018-02-16 CN disclosed
WO-2017204554-A2 METHOD FOR PREPARING SILANE DERIVATIVES FROM FURAN DERIVATIVES IN PRESENCE OF BORANE CATALYST 기초과학연구원 2017-11-30 WO disclosed
US-20110212940-A1 S1P Receptor Modulating Compounds and Use Thereof EPIX PHARMACEUTICALS, INC. (US) 2011-09-01 US disclosed
US-7919519-B2 1-(4-(5-Phenylbenzofuran-2-yl)benzyl)azetidine-3-carboxylic acids; anticarcinogenic, antiinflammatory, antiarthritic, antidiabetic agents; transplant rejection, autoimmune diseases, lupus, multiple sclerosis, psoriasis, inflammatory bowel disease, Chron's disease EPIX PHARMACEUTICALS INC. (US) 2011-04-05 US disclosed
US-20080027036-A1 S1P receptor modulating compounds and use thereof EPIX DELAWARE, INC. (US) 2008-01-31 US disclosed
US-20070173487-A1 S1P receptor modulating compounds and use thereof PREDIX PHARMACEUTICAL HOLDINGS 2007-07-26 US disclosed
EP-1689732-A2 CATIONIC SUBSTITUTED BENZOFURANS AS ANTIMICROBIAL AGENTS The University of North Carolina at Chapel Hill (US) 2006-08-16 EP disclosed
US-20050197378-A1 Cationic substituted benzofurans as antimicrobial agents TIDWELL RICHARD R (US) 2005-09-08 US disclosed
WO-2005055935-A2 CATIONIC SUBSTITUTED BENZOFURANS AS ANTIMICROBIAL AGENTS THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2005-06-23 WO disclosed
US-4766223-A FROM ALKYL BENZOFURAN AND 4-METHOXYBENZOYL HALIDE; HYDROLYSIS, DEMETHYLATION SANOFI (FR) 1988-08-23 US disclosed
US-4187234-A FIRBRINOLYTIC AND THROMBOLYTIC AGENTS CIBA-GEIGY CORPORATION (US) 1980-02-05 US disclosed
US-4001426-A HAVING CORONARY VASODILATOR ACTIVITY SMITHKLINE CORPORATION (US) 1977-01-04 US disclosed
US-3810990-A INHIBITING GROWTH OF BACTERIA US AGRICULTURE 1974-05-14 US disclosed
US-3745218-A PRESERVATION PROCESS USING 2-(4-HYDROXYPHENYL)-BENZOFURAN US AGRICULTURE 1973-07-10 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 (6 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-20080027036-A1 S1P receptor modulating compounds and use thereof S1PR1, S1PR5, S1PR2 ESR1 2497/4885ESR2 1688/4885SHBG 698/4885
US-20190337915-A1 AMIDE COMPOUNDS AND USE THEREOF GLP1R, IAPP, GPR119 ESR1 1404/4885ESR2 1515/4885SHBG 376/4885
US-20110212940-A1 S1P Receptor Modulating Compounds and Use Thereof S1PR1, S1PR5, S1PR2 ESR1 2497/4885ESR2 1688/4885SHBG 698/4885
US-20050197378-A1 Cationic substituted benzofurans as antimicrobial agents BET1, ARG2, BRDT ESR1 4263/4885ESR2 4292/4885SHBG 4552/4885
US-20070173487-A1 S1P receptor modulating compounds and use thereof S1PR1, S1PR5, S1PR2 ESR1 2497/4885ESR2 1688/4885SHBG 698/4885
US-11384060-B2 Amide compounds and use thereof GLP1R, IAPP, GPR119 ESR1 1404/4885ESR2 1515/4885SHBG 376/4885

“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.