SCHEMBL2529459

SCHEMBL2529459

O=C(O)C(OC(F)(F)F)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.45
SRC P12931 1/20 0.45
PPARG P37231 4/20 0.44
PPARA Q07869 2/20 0.44
LMNA P02545 2/20 0.43
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 1/20 0.41
CYP3A4 P08684 1/20 0.41
POLB P06746 1/20 0.41
ACP3 P15309 1/20 0.40

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
SCHEMBL17724521 1.00 CYP2D6 (0.45) CYP2D6SRCPPARGPPARALMNA
Hydrochloric Acid SCHEMBL2530813 0.98 CYP2D6 (0.43) CYP2D6SRCPPARGPPARALMNA
SCHEMBL6963705 0.86 ALDH1A1 (0.40) CYP2D6SRCPPARGPPARALMNA
SCHEMBL3458611 0.85 EPHX1 (0.43) CYP2D6SRCALDH1A1CYP3A4
SCHEMBL27715833 0.85 PPARG (0.39) CYP2D6SRCPPARGPPARALMNA
SCHEMBL4980942 0.83 PPARG (0.41) CYP2D6SRCPPARGPPARALMNA
SCHEMBL29280042 0.83 LDHA (0.42) PPARGPPARAALDH1A1
SCHEMBL4658943 0.80 POLB (0.56) LMNAALDH1A1POLB
SCHEMBL7797901 0.80 CYP2C19 (0.38) CYP2D6SRCLMNAMAPK1ALDH1A1
SCHEMBL8080541 0.80 CYP2D6 (0.45) CYP2D6SRCPPARGPPARALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250346778-A1 FLUORINE-CONTAINING COMPOUND DAIKIN INDUSTRIES, LTD. (JP) 2025-11-13 US disclosed
US-20250340752-A1 FLUORINATED POLYMER DAIKIN INDUSTRIES, LTD. (JP) 2025-11-06 US disclosed
US-20250333902-A1 FLUORINE-CONTAINING COMPOUND DAIKIN INDUSTRIES, LTD. (JP) 2025-10-30 US disclosed
EP-4574872-A1 FLUORINE-CONTAINING COMPOUND DAIKIN INDUSTRIES, LTD. (JP) 2025-06-25 EP disclosed
EP-4538304-A1 FLUORINATED POLYMER DAIKIN INDUSTRIES, LTD. (JP) 2025-04-16 EP disclosed
EP-4516773-A1 FLUORINE-CONTAINING COMPOUND DAIKIN INDUSTRIES, LTD. (JP) 2025-03-05 EP disclosed
WO-2024185687-A1 FLUORINE-CONTAINING COMPOUND ダイキン工業株式会社 2024-09-12 WO disclosed
WO-2024185707-A1 FLUORINE-CONTAINING COMPOUND ダイキン工業株式会社 2024-09-12 WO disclosed
WO-2024185688-A1 FLUORINATED POLYMER ダイキン工業株式会社 2024-09-12 WO disclosed
CN-118239953-A Compounds for the treatment of PI3K gamma mediated diseases and uses thereof 中国科学院合肥物质科学研究院 2024-06-25 CN disclosed
US-20090029999-A1 Synephrine derivatives useful as anti-inflammatory agents UNIVERSITEIT GENT (BE) 2009-01-29 US disclosed
EP-1957473-A2 PROCESS FOR PREPARING SUBSTITUTED ARYL CYCLOALKANOL DERIVATIVES Wyeth a Corporation of the State of Delaware (US) 2008-08-20 EP disclosed
WO-2007067575-A2 PROCESS FOR PREPARING SUBSTITUTED ARYL CYCLOALKANOL DERIVATIVES WYETH (US) 2007-06-14 WO disclosed
US-20070129377-A1 Process for Preparing Substituted Aryl Cycloalkanol Derivatives WYETH (US) 2007-06-07 US disclosed
US-20050026929-A1 Novel phenyl derivatives as inducers of apoptosis AXYS PHARMACEUTICALS, INC. (US) 2005-02-03 US disclosed
CN-1575191-A Treatment of insulin resistance syndrome and type 2 diabetes with PDE9 inhibitors PFIZER PROD INC (US) 2005-02-02 CN disclosed
WO-2003090680-A2 NOVEL PHENYL DERIVATIVES AS INDUCERS OF APOPTOSIS AXYS PHARMACEUTICALS, INC. (US) 2003-11-06 WO disclosed
CN-1093124-C Substituted 4-hydroxy-phenylalcanoic acid derivatives with activity to ppar-'gamma' GLAXO GROUP LTD (GB) 2002-10-23 CN disclosed
CN-1218460-A Substituted 4-hydroxy-phenylalcanoic acid derivatives with activity to ppar-'gamma' GLAXO GROUP LTD (GB) 1999-06-02 CN disclosed
EP-0608894-A1 Positive-type photosensitive resin compositions Nippon Paint Co., Ltd. (JP) 1994-08-03 EP 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 (3 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-20090029999-A1 Synephrine derivatives useful as anti-inflammatory agents HRH1, HRH3, HRH2 CYP2D6 3868/4885SRC 2667/4885PPARG 1096/4885
US-20070129377-A1 Process for Preparing Substituted Aryl Cycloalkanol Derivatives CYP1A2, CYP3A7, CYP3A43 CYP2D6 20/4885SRC 896/4885PPARG 499/4885
US-20050026929-A1 Novel phenyl derivatives as inducers of apoptosis BAX, BAD, CASP3 CYP2D6 1534/4885SRC 773/4885PPARG 136/4885

“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.