SCHEMBL457729

SCHEMBL457729

Fc1ccc(C(F)(F)F)c(Br)c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.46
IDO1 P14902 2/20 0.41
CYP11B2 P19099 2/20 0.37
CYP11B1 P15538 1/20 0.37
TRPA1 O75762 2/20 0.36
EPAS1 Q99814 2/20 0.36
KIF11 P52732 3/20 0.35
KDM1A O60341 2/20 0.35
PKM P14618 1/20 0.35
AR P10275 1/20 0.33

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
SCHEMBL29775948 1.00 NOTUM (0.46) NOTUMIDO1CYP11B2CYP11B1TRPA1
SCHEMBL15933087 0.82 NOTUM (0.36) NOTUMIDO1CYP11B2EPAS1PKM
SCHEMBL29572164 0.81 IDO1 (0.46) NOTUMIDO1TRPA1
SCHEMBL624437 0.81 IDO1 (0.46) NOTUMIDO1TRPA1
SCHEMBL11949594 0.79 PTGS1 (0.39) NOTUMPKM
SCHEMBL672252 0.78 NOTUM (0.47) NOTUMCYP11B2CYP11B1KDM1A
SCHEMBL7601736 0.77 IDO1 (0.50) NOTUMIDO1CYP11B2TRPA1KIF11
SCHEMBL3637177 0.77 PKM (0.34) NOTUMEPAS1KIF11PKM
SCHEMBL29454603 0.76 CES2 (0.50) NOTUMKIF11PKM
SCHEMBL290533 0.76 CES2 (0.50) NOTUMKIF11PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119409561-A Synthesis method of 4-fluoro-2-trifluoromethyl acetophenone 天津均凯农业科技有限公司 2025-02-11 CN claimed
EP-3478657-A1 DICARBAZOLBIPHENY DERIVATES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-05-08 EP claimed
WO-2026087650-A1 VINYLOXY-ARYL COMPOUNDS FOR THE TREATMENT OF CANCER SANOFI (FR) 2026-04-30 WO disclosed
WO-2026087651-A1 CYCLOPROPANE-ARYL COMPOUNDS FOR THE TREATMENT OF CANCER SANOFI (FR) 2026-04-30 WO disclosed
EP-4121421-B1 BIARYL DERIVATIVES AS YAP/TAZ-TEAD PROTEIN-PROTEIN INTERACTION INHIBITORS NOVARTIS AG (CH) 2026-03-11 EP disclosed
US-12440481-B2 Esters and carbamates as modulators of sodium channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-10-14 US disclosed
US-12441703-B2 Carboxamides as modulators of sodium channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-10-14 US disclosed
US-12398111-B2 Triazine compounds and pharmaceutical use thereof JAPAN TOBACCO INC. (JP) 2025-08-26 US disclosed
WO-2025059373-A1 NOVEL PHENALKYLAMINES AND THEIR USE IN THE TREATMENT OF PSYCHIATRIC DISORDERS GILGAMESH PHARMACEUTICALS, INC. (US) 2025-03-20 WO disclosed
CN-119409561-A Synthesis method of 4-fluoro-2-trifluoromethyl acetophenone 天津均凯农业科技有限公司 2025-02-11 CN disclosed
CN-119409561-A Synthesis method of 4-fluoro-2-trifluoromethyl acetophenone 天津均凯农业科技有限公司 2025-02-11 CN disclosed
US-20050234057-A1 1-Phenylpiperidin-3-one derivatives and processes for the preparation thereof DONG-A PHARMACEUTICAL CO., LTD. (KR) 2005-10-20 US disclosed
US-20050215784-A1 Pharmaceutical compositions as inhibitors of dipeptidyl peptidase-IV (DPP-IV) ABBVIE INC. 2005-09-29 US disclosed
EP-1560811-A2 PHARMACEUTICAL COMPOSITIONS AS INHIBITORS OF DIPEPTIDYL PEPTIDASE-IV (DPP-IV) Abbott Laboratories (US) 2005-08-10 EP disclosed
US-20040259843-A1 Pharmaceutical compositions as inhibitors of dipeptidyl peptidase-IV (DPP-IV) ABBVIE INC. 2004-12-23 US disclosed
US-20040162303-A1 4-aminopyrimidine-5-one derivatives BARTKOVITZ DAVID JOSEPH (US) 2004-08-19 US disclosed
WO-2004069139-A2 4-AMINOPYRIMIDIN-5-YL-METHANONE DERIVATIVES FOR INHIBITION OF CDK4 ACTIVITY F.HOFFMANN-LA ROCHE AG (CH) 2004-08-19 WO disclosed
US-20040121964-A1 Pharmaceutical compositions as inhibitors of dipeptidyl peptidase-IV (DPP-IV) ABBOTT LABORATORIES 2004-06-24 US disclosed
WO-2004026822-A2 PHARMACEUTICAL COMPOSITIONS AS INHIBITORS OF DIPEPTIDYL PEPTIDASE-IV (DPP-IV) ABBOTT LABORATORIES (US) 2004-04-01 WO disclosed
WO-2004011457-A1 1-PHENYLPIPERIDIN-3-ONE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2004-02-05 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-20040121964-A1 Pharmaceutical compositions as inhibitors of dipeptidyl peptidase-IV (DPP-IV) DPP4, DPP3, DPP7 NOTUM 765/4885IDO1 454/4885CYP11B2 2929/4885
US-12441703-B2 Carboxamides as modulators of sodium channels TRPV1, SCN2A, SCN10A NOTUM 1598/4885IDO1 3851/4885CYP11B2 3887/4885
US-20050215784-A1 Pharmaceutical compositions as inhibitors of dipeptidyl peptidase-IV (DPP-IV) DPP4, DPP3, DPP7 NOTUM 768/4885IDO1 449/4885CYP11B2 3023/4885
US-20040162303-A1 4-aminopyrimidine-5-one derivatives CDK4, CDKL4, CDK6 NOTUM 2358/4885IDO1 3596/4885CYP11B2 1730/4885
US-20040259843-A1 Pharmaceutical compositions as inhibitors of dipeptidyl peptidase-IV (DPP-IV) DPP4, DPP3, DPP7 NOTUM 765/4885IDO1 454/4885CYP11B2 2929/4885
US-12440481-B2 Esters and carbamates as modulators of sodium channels SCN10A, CACNA1A, SCN3A NOTUM 453/4885IDO1 4851/4885CYP11B2 2792/4885
US-20050234057-A1 1-Phenylpiperidin-3-one derivatives and processes for the preparation thereof CTRL, PRCP, CLPP NOTUM 753/4885IDO1 931/4885CYP11B2 2814/4885
US-12398111-B2 Triazine compounds and pharmaceutical use thereof PTGIS, PTGS1, PTGES NOTUM 3279/4885IDO1 393/4885CYP11B2 485/4885

“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.