SCHEMBL461337

SCHEMBL461337

O=C(O)C1(O)CC=Cc2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
AKR1C1 Q04828 1/20 0.35
HDAC4 P56524 2/20 0.33
KDM4E B2RXH2 2/20 0.32
PKM P14618 1/20 0.32
KIF11 P52732 3/20 0.31
ALDH1A1 P00352 1/20 0.30
HTT P42858 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
HSD11B1 P28845 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
SCHEMBL10586576 0.84 KDM4E (0.34) THRBTDP1HDAC4KDM4EPKM
SCHEMBL5857537 0.84 LMNA (0.33) THRBTDP1HDAC4KDM4EPKM
SCHEMBL29701281 0.84 KDM4E (0.34) THRBTDP1HDAC4KDM4EPKM
SCHEMBL387970 0.81 L3MBTL1 (0.35) THRBTDP1KDM4EALDH1A1
SCHEMBL8660719 0.81 MEN1 (0.40) TDP1HDAC4ALDH1A1NPSR1
SCHEMBL7109806 0.80 MAPT (0.39) HDAC4KDM4EPKMKIF11ALDH1A1
SCHEMBL9155004 0.80 THRB (0.37) THRBTDP1AKR1C1HDAC4KIF11
Hydrochloric Acid SCHEMBL28933194 0.79 THRB (0.36) THRBTDP1AKR1C1HDAC4KIF11
Oxalic Acid SCHEMBL29053840 0.79 THRB (0.36) THRBTDP1AKR1C1HDAC4KDM4E
SCHEMBL9899733 0.77 THRB (0.35) THRBTDP1AKR1C1HDAC4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119930564-A GL-V8 salt and preparation method and application thereof 南京芩领医药科技有限公司 2025-05-06 CN claimed
CN-117865984-A Naphthalene compound and preparation method and medical application thereof 中国药科大学 2024-04-12 CN claimed
EP-4118145-A1 LIQUID CRYSTAL POLYMER COMPOSITIONS AND CORRESPONDING ARTICLES Solvay Specialty Polymers USA, LLC. (US) 2023-01-18 EP claimed
CN-111973596-B Anti-pulmonary fibrosis composition with improved dissolution property 深圳市泰力生物医药有限公司 2022-02-15 CN claimed
EP-2841066-B1 ANTI-INFLUENZA AGENT CONJUGATED TO ANTI-INFLAMMATORY AGENT ACADEMIA SINICA (TW) 2021-02-17 EP claimed
CN-112294971-A Nilotinib compositions having improved solubility 深圳市泰力生物医药有限公司 2021-02-02 CN claimed
CN-111973596-A Anti-pulmonary fibrosis composition with improved dissolution property 深圳市泰力生物医药有限公司 2020-11-24 CN claimed
CN-111467501-A Compositions with improved dissolution properties 深圳市泰力生物医药有限公司 2020-07-31 CN claimed
US-10138221-B2 Salts of nilotinib and polymorphs thereof SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2018-11-27 US claimed
EP-3273962-A1 CO-CRYSTALS OF A BRUTON'S TYROSINE KINASE INHIBITOR Pharmacyclics LLC (US) 2018-01-31 EP claimed
WO-2009155462-A1 DETECTION OF FREE CHLORINE IN WATER HACH COMPANY (US) 2009-12-23 WO claimed
WO-2008077871-A1 SALTS OF TEGASEROD NOVARTIS AG (CH) 2008-07-03 WO claimed
EP-1939176-A1 Salts of Tegaserod Novartis AG (CH) 2008-07-02 EP claimed
WO-2007070563-A2 STABLE SOLID FORMS OF ENTEROSTATIN HARKNESS PHARMACEUTICALS, INC. (US) 2007-06-21 WO claimed
US-7196214-B2 Process for arylamine production XEROX CORPORATION (US) 2007-03-27 US claimed
CN-1266126-C Phenylethanolamine derivatives for the treatment of respiratory diseases GLAXO GROUP LTD (GB) 2006-07-26 CN claimed
US-20060111582-A1 Process for arylamine production XEROX CORPORATION (US) 2006-05-25 US claimed
EP-1606329-A1 A PROCESS FOR THE PRODUCTION OF ACID GROUP CONTAINING POLYMER RESIN SigmaKalon B.V. (NL) 2005-12-21 EP claimed
WO-2004085502-A1 A PROCESS FOR THE PRODUCTION OF ACID GROUP CONTAINING POLYMER RESIN SIGMAKALON B.V. (NL) 2004-10-07 WO claimed
EP-1462467-A1 A process for the production of silyl group containing polymer resin Sigma Kalon Services B.V. (NL) 2004-09-29 EP 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-20060111582-A1 Process for arylamine production AOC2, UFM1, TYR THRB 715/4885TDP1 4328/4885AKR1C1 3217/4885
US-10138221-B2 Salts of nilotinib and polymorphs thereof ABL1, PTPN13, PTPN1 THRB 2593/4885TDP1 135/4885AKR1C1 1355/4885

“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.