SCHEMBL458841

SCHEMBL458841

O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(Cl)nc1C(F)(F)F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 16/20 1.00
ATF1 P18846 9/20 1.00
JUN P05412 8/20 1.00
NFKB2 Q00653 8/20 1.00
RELA Q04206 8/20 1.00
XPO1 O14980 6/20 1.00

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
SCHEMBL8561758 0.88 NFKB1 (1.00) NFKB1ATF1JUNNFKB2RELA
SCHEMBL1864557 0.88 NFKB1 (0.78) NFKB1ATF1JUNNFKB2RELA
SCHEMBL1862523 0.78 NFKB1 (0.74) NFKB1ATF1JUNNFKB2RELA
SCHEMBL13077672 0.77 XPO1 (0.71) NFKB1ATF1JUNNFKB2RELA
SCHEMBL13077675 0.77 XPO1 (0.69) NFKB1ATF1JUNNFKB2RELA
SCHEMBL8557809 0.76 NFKB1 (0.75) NFKB1ATF1JUNNFKB2RELA
SCHEMBL8518174 0.75 NFKB1 (0.62) NFKB1ATF1JUNNFKB2RELA
SCHEMBL330789 0.75 P2RX1 (0.64) NFKB1ATF1JUNNFKB2RELA
SCHEMBL3128576 0.74 NFKB1 (0.61) NFKB1ATF1JUNNFKB2RELA
SCHEMBL2307377 0.74 NFKB1 (0.61) NFKB1ATF1JUNNFKB2RELA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026087680-A1 TREATMENT FOR CARDIOVASCULAR DISEASE SAPREME TECHNOLOGIES B.V. (NL) 2026-04-30 WO claimed
WO-2026087695-A1 TREATMENT FOR METABOLIC DISORDER SAPREME TECHNOLOGIES B.V. (NL) 2026-04-30 WO claimed
US-20250011425-A1 COMPOSITIONS AND METHODS FOR IMPROVED T CELLS UNIV TEMPLE (US) 2025-01-09 US claimed
US-20240316012-A1 METHODS FOR TREATING LYMPHOMA NORTHWESTERN UNIVERSITY (US) 2024-09-26 US claimed
US-20240261333-A1 NOVEL TARGETS FOR ENHANCING ANTI-TUMOR IMMUNITY NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2024-08-08 US claimed
US-12024715-B2 Compositions and methods for improved T cells TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2024-07-02 US claimed
WO-2022256620-A1 NOVEL TARGETS FOR ENHANCING ANTI-TUMOR IMMUNITY THE BROAD INSTITUTE, INC. (US) 2022-12-08 WO claimed
US-20180117067-A1 METHODS AND COMPOSITIONS FOR TREATING PANCREATITIS BAYLOR RESEARCH INSTITUTE 2018-05-03 US claimed
WO-2016160880-A1 METHODS AND COMPOSITIONS FOR TREATING PANCREATITIS BAYLOR RESEARCH INSTITUTE (US) 2016-10-06 WO claimed
EP-1393277-B1 USE OF NF-Kappa-B INHIBITORS TO TREAT DRY EYE DISORDERS ALCON INC (CH) 2006-07-19 EP claimed
EP-1542768-A1 USE OF CYTOKINE SYNTHESIS INHIBITORS FOR THE TREATMENT OF DRY EYE DISORDERS Alcon, Inc. (CH) 2005-06-22 EP claimed
WO-2004098510-A2 CYSTIC FIBROSIS THERAPY BETH ISRAEL DEACONESS MEDICAL CENTER (US) 2004-11-18 WO claimed
WO-2004026406-A1 USE OF CYTOKINE SYNTHESIS INHIBITORS FOR THE TREATMENT OF DRY EYE DISORDERS ALCON, INC. (CH) 2004-04-01 WO claimed
US-20040058875-A1 Methods of treating dry eye disorders ALCON, INC. 2004-03-25 US claimed
US-6696453-B2 ADMINISTERING NF- KAPPA B INHIBITORS FOR THERAPY OF DRY EYES ALCON, INC. (CH) 2004-02-24 US claimed
WO-2002095704-A9 USE OF NF-KAPPA-B INHIBITORS TO TREAT DRY EYE DISORDERS ALCON INC (CH) 2003-02-27 WO claimed
US-20030008854-A1 Use of NF-kappabeta inhibitors to treat dry eye disorders ALCON, INC. 2003-01-09 US claimed
EP-4735446-A1 SALTS AND SOLID FORMS OF A COMPOUND THAT MODULATES IRAK4 GILEAD SCIENCES, INC. (US) 2026-05-06 EP disclosed
WO-2002095704-A1 USE OF NF-KAPPA-B INHIBITORS TO TREAT DRY EYE DISORDERS ALCON, INC. (CH) 2002-11-28 WO disclosed
WO-2002086076-A2 POLYNUCLEOTIDES AND POLYPEPTIDES ASSOCIATED WITH THE NF-KB PATHWAY BRISTOL-MYERS SQUIBB COMPANY (US) 2002-10-31 WO disclosed