SCHEMBL77640

SCHEMBL77640

COc1[c]ccc(OC)c1OC

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA4 P22748 1/20 0.35
CA7 P43166 1/20 0.35
CA14 Q9ULX7 1/20 0.35
ACHE P22303 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
MAPT P10636 2/20 0.33
CYP3A4 P08684 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
TUBB4A P04350 1/20 0.32
TUBB P07437 1/20 0.32
TUBA3C P0DPH7 1/20 0.32
TUBA1B P68363 1/20 0.32

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
SCHEMBL10345470 0.82 NCOA1 (0.36) MAPTCYP3A4KDM4EALDH1A1MAPK1
SCHEMBL6033447 0.82 MEN1 (0.31) SMN1; SMN2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL28751648 0.82 GAA (0.33) ALDH1A1
SCHEMBL28792612 0.82 POLB (0.31) SMN1; SMN2HPGDMAPK1
SCHEMBL28327253 0.81 ALDH1A1 (0.47) CA9CA12CA1CA2CA4
SCHEMBL7724425 0.80 CA12 (0.33) CA9CA12CA1CA2CA4
SCHEMBL9672165 0.79 KDM4E (0.41) SMN1; SMN2MAPTTDP1KDM4EALDH1A1
SCHEMBL9671757 0.79 MAPK1 (0.40) SMN1; SMN2MAPTTDP1KDM4EALDH1A1
SCHEMBL11563992 0.79 SMN1; SMN2 (0.43) SMN1; SMN2MAPTKDM4EALDH1A1HPGD
SCHEMBL11567414 0.79 SMN1; SMN2 (0.43) SMN1; SMN2MAPTTDP1ALDH1A1HPGD

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

Appears in 3018 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117831652-A Prediction method of olefin hydroformylation positive-to-negative ratio 上海华谊控股集团有限公司 2024-04-05 CN claimed
CN-114206886-B Gold (III) compound, method for preparing the same, and organic light emitting device using the same 广东聚华印刷显示技术有限公司 2024-02-27 CN claimed
EP-4112053-B1 TREATMENT OF SYNUCLEINOPATHIES DEUTSCHES ZENTRUM FUER NEURODEGENERATIVE ERKRANKUNGEN E V DZNE (DE) 2024-02-14 EP claimed
EP-3701934-B1 COMPOSITION FOR PROMOTING ADIPOCYTE DIFFERENTIATION OR ADIPONECTIN, COMPRISING TRIMETHOXY PHENYL COMPOUND AMOREPACIFIC CORP (KR) 2024-01-17 EP claimed
US-20230183249-A1 NEW TRIAZINOINDOLE COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2023-06-15 US claimed
CN-111432791-B Composition for promoting adipocyte differentiation or adiponectin comprising trimethoxyphenyl compound 株式会社爱茉莉太平洋 2023-05-02 CN claimed
WO-2023070120-A1 KETOAMIDES FOR TREATING MALIGNANCY BIOTHERYX, INC. (US) 2023-04-27 WO claimed
EP-4143192-A1 NEW TRIAZINOINDOLE COMPOUNDS JANSSEN Pharmaceutica NV (BE) 2023-03-08 EP claimed
CN-113979975-B Chiral phosphoric acid catalyzed aryl allyl tertiary alcohol kinetic resolution method 浙江工业大学 2023-02-28 CN claimed
EP-4112053-A1 TREATMENT OF SYNUCLEINOPATHIES Deutsches Zentrum für Neurodegenerative Erkrankungen e.V. (DZNE) (DE) 2023-01-04 EP claimed
US-4241052-A ANTILEUKEMIC AND ANTICARCINOGENIC AGENTS TANABE SEIYAKU CO., LTD. (JP) 1980-12-23 US claimed
US-4188389-A 1,2,3,4-Tetrahydropyrrolo(1,2-A)pyrazines AYERST MCKENNA & HARRISON, INC. (CA) 1980-02-12 US claimed
US-4154837-A ANTIARRHYTHMIC, ADRENERGIC BLOCKING AGENTS, ANTIANGINOUS BOEHRINGER INGELHEIM GMBH (DE) 1979-05-15 US claimed
US-4054659-A BRONCHODILATORS TANABE SEIYAKU CO., LTD. (JA) 1977-10-18 US claimed
US-4044141-A CORONARY DILATING, SPASMOLYTIC, HYPOTENSIVE AGENTS BAYER AKTIENGESELLSCHAFT (DT) 1977-08-23 US claimed
US-4024273-A Coronary vasodilator and anti-anginal compositions comprising substituted benzofurans and benzothiophenes and methods of producing coronary vasodilation and anti-anginal activity SMITHKLINE CORPORATION (US) 1977-05-17 US claimed
US-4010162-A Substituted phenanthroline pigments ALLIED CHEMICAL CORPORATION (US) 1977-03-01 US claimed
US-3953432-A OXAZOLINE DERIVATIVES COMMERCIAL SOLVENTS CORPORATION (US) 1976-04-27 US claimed
US-3947470-A CORONARY VASODILATORS, TREATMENT OF ANGINA PECTORIS SMITHKLINE CORPORATION (US) 1976-03-30 US claimed
US-3941783-A Process for the production of N,N-disubstituted carboxylic amides ESZAKMAGYARORSZAGI VEGYIMUVEK (HU) 1976-03-02 US claimed