SCHEMBL542320

SCHEMBL542320

OB(O)/C=C/c1ccc(C(F)(F)F)cc1

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.89
CA2 P00918 1/20 0.89
CYP1A2 P05177 1/20 0.55
PTGS1 P23219 1/20 0.53
MGLL Q99685 2/20 0.52
NQO2 P16083 1/20 0.52
HDAC3 O15379 1/20 0.50
ADAM17 P78536 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
HDAC5 Q9UQL6 1/20 0.50
AHR P35869 1/20 0.48
ORAI1 Q96D31 1/20 0.48
ORAI2 Q96SN7 1/20 0.48
ORAI3 Q9BRQ5 1/20 0.48
TRPV6 Q9H1D0 1/20 0.48

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
SCHEMBL542321 1.00 CA1 (0.89) CA1CA2CYP1A2PTGS1MGLL
SCHEMBL22931544 0.79 AHR (0.68) CA1CA2CYP1A2PTGS1NQO2
SCHEMBL13790263 0.79 AHR (0.68) CA1CA2CYP1A2PTGS1NQO2
SCHEMBL13790273 0.79 AHR (0.68) CA1CA2CYP1A2PTGS1NQO2
SCHEMBL2909442 0.79 CA1 (0.59) CA1CA2CYP1A2PTGS1MGLL
SCHEMBL2909444 0.79 CA1 (0.59) CA1CA2CYP1A2PTGS1MGLL
SCHEMBL2352948 0.77 CA1 (0.57) CA1CA2MGLLFBP1P4HB
SCHEMBL3317126 0.77 CA1 (0.57) CA1CA2MGLLFBP1P4HB
SCHEMBL29507308 0.77 AHR (0.65) CA1CA2CYP1A2PTGS1NQO2
SCHEMBL13204210 0.76 CA1 (0.61) CA1CA2PTGS1MGLLORAI1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8361484-B2 Polymer systems for lung volume reduction therapy AERIS THERAPEUTICS, INC. (US) 2013-01-29 US claimed
US-20100040538-A1 Polymer Systems for Lung Volume Reduction Therapy CANADIAN IMPERIAL BANK OF COMMERCE (CA) 2010-02-18 US claimed
EP-2059227-A2 POLYMER SYSTEMS FOR LUNG VOLUME REDUCTION THERAPY Aeris Therapeutics, Inc. (US) 2009-05-20 EP claimed
WO-2008039827-A2 POLYMER SYSTEMS FOR LUNG VOLUME REDUCTION THERAPY AERIS THERAPEUTICS, INC. (US) 2008-04-03 WO claimed
EP-3768675-B1 NOVEL TRIAZOLONE DERIVATIVES OR SALTS THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME YUHAN CORP (KR) 2026-04-01 EP disclosed
US-12512511-B2 Solid electrolyte including polymer containing boron and fluorine structure, preparation method, and lithium ion battery including the same ZHUHAI COSMX BATTERY CO., LTD. (CN) 2025-12-30 US disclosed
US-20250282735-A1 BICYCLE COMPOUNDS AS TEAD INHIBITOR DONG-A ST CO., LTD. (KR) 2025-09-11 US disclosed
EP-4514780-A1 BICYCLE COMPOUNDS AS TEAD INHIBITOR Dong-A ST Co., Ltd. (KR) 2025-03-05 EP disclosed
US-20250066365-A1 Ribonucleoside Analogues Against -Sars-Cov-2 KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2025-02-27 US disclosed
US-12186313-B2 Pyridazinone compounds and their use as DAAO inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2025-01-07 US disclosed
EP-3885342-B1 BICYCLIC INHIBITORS OF PAD4 PADLOCK THERAPEUTICS INC (US) 2024-11-20 EP disclosed
EP-4405357-A1 RIBONUCLEOSIDE ANALOGUES AGAINST -SARS-COV-2 Katholieke Universiteit Leuven KU Leuven Research & Development (BE) 2024-07-31 EP disclosed
US-7091214-B2 Aryl substituted Imidazoquinolines 3M INNOVATIVE PROPERTIES CO. (US) 2006-08-15 US disclosed
US-20060111387-A1 ARYL SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES COMPANY 2006-05-25 US disclosed
WO-2006027365-A1 2-SUBSTITUTED-6-TRIFLUOROMETHYL PURINE DERIVATIVES WITH ADENOSINE-A3 ANTAGONISTIC ACTIVITY SOLVAY PHARMACEUTICALS B.V. (NL) 2006-03-16 WO disclosed
EP-1633750-A2 SYNTHESIS OF 5-SUBSTITUTED 7-AZAINDOLES AND 7-AZAINDOLINES Eisai Co., Ltd. (JP) 2006-03-15 EP disclosed
US-20060052331-A1 2-Substituted-6-trifluoromethyl purine derivatives with adenosine-A3 antagonistic activity SOLVAY PHARMACEUTICALS B.V. (NL) 2006-03-09 US disclosed
US-20060020004-A1 Isoxazolidine compounds for treatment of bacterial infections INFINITY PHARMACEUTICALS, INC. (US) 2006-01-26 US disclosed
WO-2006009907-A2 ISOXAZOLIDINE COMPOUNDS FOR TREATMENT OF BACTERIAL INFECTIONS INFINITY PHARMACEUTICALS, INC. (US) 2006-01-26 WO disclosed
WO-2004078757-A2 SYNTHESIS OF 5-SUBSTITUTED 7-AZAINDOLES AND 7-AZAIDONINES EISAI CO., LTD. (JP) 2004-09-16 WO 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 (8 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-20250066365-A1 Ribonucleoside Analogues Against -Sars-Cov-2 SARS1, NSUN2, ACE2 CA1 4843/4885CA2 3401/4885CYP1A2 1023/4885
US-20060020004-A1 Isoxazolidine compounds for treatment of bacterial infections QDPR, NQO2, SQLE CA1 4344/4885CA2 2200/4885CYP1A2 101/4885
US-12186313-B2 Pyridazinone compounds and their use as DAAO inhibitors PNPO, DAO, DPYD CA1 3015/4885CA2 3315/4885CYP1A2 8/4885
US-20060052331-A1 2-Substituted-6-trifluoromethyl purine derivatives with adenosine-A3 antagonistic activity ADORA3, ADORA2A, ADORA2B CA1 4393/4885CA2 3286/4885CYP1A2 744/4885
US-20250282735-A1 BICYCLE COMPOUNDS AS TEAD INHIBITOR TEAD1, TEAD2, TEAD3 CA1 576/4885CA2 881/4885CYP1A2 62/4885
US-20100040538-A1 Polymer Systems for Lung Volume Reduction Therapy GFER, MUC1, CTH CA1 1918/4885CA2 2856/4885CYP1A2 2482/4885
US-12512511-B2 Solid electrolyte including polymer containing boron and fluorine structure, preparation method, and lithium ion battery including the same SCN2B, VMP1, BRD9 CA1 792/4885CA2 660/4885CYP1A2 3363/4885
US-20060111387-A1 ARYL SUBSTITUTED IMIDAZOQUINOLINES IL2, IFNG, IRF3 CA1 4409/4885CA2 4410/4885CYP1A2 850/4885

“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.