SCHEMBL395819

SCHEMBL395819

C1=Cc2ccccc2OOC1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.32
ITGB2 P05107 1/20 0.32
ICAM1 P05362 1/20 0.32
ITGAL P20701 1/20 0.32
STS P08842 1/20 0.30

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
SCHEMBL7690961 0.80 CYP2B6 (0.42) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL6266959 0.78 CYP2B6 (0.41) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL27687452 0.78 CYP2B6 (0.41) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL6419763 0.78 CYP2B6 (0.41) KDM4EMEN1ALDH1A1MAPTKMT2A
Magnesium SCHEMBL9492700 0.78 CYP2B6 (0.41) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL2514484 0.78 CYP2B6 (0.41) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL27994723 0.78 CYP2B6 (0.41) KDM4EMEN1ALDH1A1MAPTKMT2A
Magnesium SCHEMBL4423652 0.78 CYP2B6 (0.41) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL28896760 0.78 CYP2B6 (0.41) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL9208 0.77 CYP2B6 (0.43) KDM4EMEN1ALDH1A1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114044779-B Organic electron transport material containing benzodioxan and application thereof 上海传勤新材料有限公司 2023-02-14 CN claimed
CN-114044779-A Organic electron transport material containing benzodioxan and application thereof 上海传勤新材料有限公司 2022-02-15 CN claimed
WO-2021132627-A1 METHOD FOR CULTURING HEMATOPOIETIC STEM CELLS 大日本住友製薬株式会社 2021-07-01 WO claimed
EP-3206660-B1 MALODOR REDUCING COMPOSITIONS GIVAUDAN SA (CH) 2021-03-31 EP claimed
US-20170290757-A1 MALODOR REDUCING COMPOSITIONS GIVAUDAN S.A. (CH) 2017-10-12 US claimed
EP-3206660-A1 MALODOR REDUCING COMPOSITIONS Givaudan S.A. (CH) 2017-08-23 EP claimed
WO-2016058710-A1 MALODOR REDUCING COMPOSITIONS GIVAUDAN SA (CH) 2016-04-21 WO claimed
CN-105473641-A Method for preparing dioxyheterocycle-based electrochromic polymers UNIV FLORIDA 2016-04-06 CN claimed
EP-1933622-B1 BICYCLOHETEROARYL COMPOUNDS AS P2X7 MODULATORS AND USES THEREOF SECOND GENOME INC (US) 2016-03-09 EP claimed
US-9180192-B2 mGluR4 allosteric potentiators, compositions, and methods of treating neurological dysfunction VANDERBILT UNIVERSITY (US) 2015-11-10 US claimed
EP-1597254-A1 INDOLE-DERIVATIVE MODULATORS OF STEROID HORMONE NUCLEAR RECEPTORS Eli Lilly and Company (US) 2005-11-23 EP claimed
US-20050203069-A1 Nitric oxide-releasing molecules NOXILIZER, INC. 2005-09-15 US claimed
WO-2005081752-A2 NITRIC OXIDE-RELEASING POLYMERS AMULET PHARMACEUTICALS, INC. (US) 2005-09-09 WO claimed
WO-2005081753-A2 NITRIC OXIDE-RELEASING MOLECULES NOXILIZER, INC. (US) 2005-09-09 WO claimed
EP-1289980-B1 BICYCLYL OR HETEROBICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED N-HYDROXYFORMAMIDES SMITHKLINE BEECHAM PLC (GB) 2004-11-17 EP claimed
WO-2004067529-A1 INDOLE-DERIVATIVE MODULATORS OF STEROID HORMONE NUCLEAR RECEPTORS ELI LILLY AND COMPANY (US) 2004-08-12 WO claimed
US-20040024066-A1 Bicyclyl or heterobicyclylmethanesulfonylamino-substituted n-hydroxyformamides SMITHKLINE BEECHAM P.L.C. (GB) 2004-02-05 US claimed
EP-1289980-A1 BICYCLYL OR HETEROBICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED N-HYDROXYFORMAMIDES SMITHKLINE BEECHAM PLC (GB) 2003-03-12 EP claimed
WO-2001090100-A1 BICYCLYL OR HETEROBICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED N-HYDROXYFORMAMIDES SMITHKLINE BEECHAM P.L.C. (GB) 2001-11-29 WO claimed
US-5225427-A 10-substituted ether derivatives of dihydroartemisinin, process for their preparation and their use as antiprotozoal agents HOECHST AKTIENGESELLSCHAFT (DE) 1993-07-06 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20050203069-A1 Nitric oxide-releasing molecules NOS2, NOS1, NOS3 KDM4E 3118/4885MEN1 738/4885ALDH1A1 2203/4885
US-20040024066-A1 Bicyclyl or heterobicyclylmethanesulfonylamino-substituted n-hydroxyformamides CD22, CD2, NEU3 KDM4E 4541/4885MEN1 1518/4885ALDH1A1 356/4885

“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.