SCHEMBL25405083

SCHEMBL25405083

COCOc1cc(C(F)(F)F)cc(C)c1I

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 2/20 0.33
KMT2A Q03164 1/20 0.33
EGFR P00533 1/20 0.32
PPARD Q03181 3/20 0.31
ABCG2 Q9UNQ0 1/20 0.31
AGBL2 Q5U5Z8 1/20 0.30
RAPGEF4 Q8WZA2 1/20 0.30
CACNA1H O95180 1/20 0.30
IDO1 P14902 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
SCHEMBL30994254 0.89 EGFR (0.34) EGFR
SCHEMBL30994302 0.84 GABRB3 (0.37) HPGDKMT2A
SCHEMBL22655143 0.84 L3MBTL1 (0.35) KDM4EALDH1A1HPGDPPARD
SCHEMBL23899711 0.84 NOTUM (0.33) KDM4EHTTKMT2AEGFR
SCHEMBL30375605 0.84 L3MBTL1 (0.35) KDM4EALDH1A1HPGDPPARD
SCHEMBL22654828 0.80 ABCG2 (0.37) KMT2AABCG2RAPGEF4
SCHEMBL30743622 0.80 ABCG2 (0.37) KMT2AABCG2RAPGEF4
SCHEMBL30994374 0.80 PPARD (0.32) PPARD
SCHEMBL30994139 0.79 PTPN1 (0.30)
SCHEMBL531949 0.78 RAPGEF4 (0.42) ALDH1A1AGBL2RAPGEF4IDO1

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4680601-A1 PYRIDAZINE COMPOUNDS, THEIR PREPARATION, AND THEIR THERAPEUTIC USES Sanofi (FR) 2026-01-21 EP disclosed
EP-4658640-A1 PYRIDIN-2(1H)-ONES AND PYRIMIDIN-4(3H)-ONES AS NLRP3 INHIBITORS Janssen Pharmaceutica NV (BE) 2025-12-10 EP disclosed
EP-4656635-A1 SUBSTITUTED BENZENE COMPOUND Daiichi Sankyo Company, Limited (JP) 2025-12-03 EP disclosed
EP-4562009-A1 NOVEL COMPOUNDS AC Immune SA (CH) 2025-06-04 EP disclosed
EP-4493556-A1 NLRP3 MODULATORS Zomagen Biosciences Ltd (US) 2025-01-22 EP disclosed
CN-119301116-A NLRP3 modulators 祖玛珍生物科学有限公司 2025-01-10 CN disclosed
US-20240360151-A1 PYRIDAZINE COMPOUNDS, THEIR PREPARATION, AND THEIR THERAPEUTIC USES SANOFI (FR) 2024-10-31 US disclosed
WO-2024188994-A1 PYRIDAZINE COMPOUNDS, THEIR PREPARATION, AND THEIR THERAPEUTIC USES SANOFI (FR) 2024-09-19 WO disclosed
WO-2024160693-A1 PYRIDIN-2(1H)-ONES AND PYRIMIDIN-4(3H)-ONES AS NLRP3 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2024-08-08 WO disclosed
US-20240262806-A1 INHIBITORS OF NLRP3 PCT THERAPEUTICS, INC. (US) 2024-08-08 US disclosed
WO-2024157953-A1 SUBSTITUTED BENZENE COMPOUND 第一三共株式会社 2024-08-02 WO disclosed
CN-118302417-A NLRP3 inhibitors PTC医疗公司 2024-07-05 CN disclosed
US-20240101563-A1 NOVEL COMPOUNDS AC IMMUNE SA (CH) 2024-03-28 US disclosed
WO-2024023266-A1 NOVEL COMPOUNDS AC IMMUNE SA (CH) 2024-02-01 WO disclosed
WO-2023178099-A1 NLRP3 MODULATORS ZOMAGEN BIOSCIENCES LTD (US) 2023-09-21 WO disclosed
US-20230295113-A1 NLRP3 MODULATORS ZOMAGEN BIOSCIENCES LTD 2023-09-21 US disclosed
US-20230295113-A1 NLRP3 MODULATORS ZOMAGEN BIOSCIENCES LTD 2023-09-21 US disclosed
US-20230295113-A1 NLRP3 MODULATORS ZOMAGEN BIOSCIENCES LTD 2023-09-21 US 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 (4 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-20240360151-A1 PYRIDAZINE COMPOUNDS, THEIR PREPARATION, AND THEIR THERAPEUTIC USES NLRP3, NOD1, NLRP1 KDM4E 3755/4885ALDH1A1 3601/4885HPGD 1295/4885
US-20240262806-A1 INHIBITORS OF NLRP3 NLRP3, NOD1, NLRP1 KDM4E 2198/4885ALDH1A1 3173/4885HPGD 1920/4885
US-20240101563-A1 NOVEL COMPOUNDS NLRP3, NOD1, NLRP1 KDM4E 4607/4885ALDH1A1 2336/4885HPGD 1267/4885
US-20230295113-A1 NLRP3 MODULATORS NLRP3, NLRP1, NOD1 KDM4E 4253/4885ALDH1A1 2633/4885HPGD 964/4885

“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.