SCHEMBL589562

SCHEMBL589562

O=c1ccc(Br)cn1C(F)F

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 8/20 0.49
CREBBP Q92793 1/20 0.33
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
FAAH O00519 1/20 0.30
MGLL Q99685 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
SCHEMBL506044 0.78 ADORA2A (0.38) PTGS2ALDH1A1LMNA
SCHEMBL506398 0.75 PTGS2 (0.35) PTGS2TDP1
SCHEMBL15046628 0.74 PTGS2 (0.51) PTGS2CREBBPALDH1A1
SCHEMBL505992 0.71 PTGS2 (0.35) PTGS2ALDH1A1LMNA
SCHEMBL506213 0.71 PTGS2 (0.45) PTGS2ALDH1A1
SCHEMBL506014 0.70 MEN1 (0.33) PTGS2ALDH1A1
SCHEMBL31313713 0.70 KDM4E (0.35) TDP1FAAHMGLL
SCHEMBL15046558 0.69 PTGS2 (0.62) PTGS2CREBBPALDH1A1LMNATDP1
SCHEMBL1852937 0.69 PTGS2 (0.57) PTGS2
SCHEMBL16064383 0.69 KMT2A (0.36) PTGS2ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4688778-A1 1H-PYRROLO[2,3-B]PYRIDIN-4-YL]-2-OXOPYRROLIDINE-3-CARBONITRILE DERIVATIVES AS TYROSINE KINASE 2 (TYK2) INHIBITORS FOR THE TREATMENT OF INFLAMMATORY DISEASES Biogen MA Inc. (US) 2026-02-11 EP disclosed
US-20250304577-A1 TYK2 INHIBITORS BIOGEN MA INC. 2025-10-02 US disclosed
EP-4373817-B1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2025-05-21 EP disclosed
US-20250092040-A1 AKT1 MODULATORS ALTEROME THERAPEUTICS, INC. 2025-03-20 US disclosed
CN-119241424-A Preparation method of 2- (difluoromethoxy) -5-bromopyridine 浙江药领医药科技有限公司 2025-01-03 CN disclosed
US-20240374606-A1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2024-11-14 US disclosed
US-20240360157-A1 TYK2 INHIBITORS BIOGEN MA INC. 2024-10-31 US disclosed
WO-2024211696-A1 1H-PYRROLO[2,3-B]PYRIDIN-4-YL]-2-OXOPYRROLIDINE-3-CARBONITRILE DERIVATIVES AS TYROSINE KINASE 2 (TYK2) INHIBITORS FOR THE TREATMENT OF INFLAMMATORY DISEASES BIOGEN MA INC. (US) 2024-10-10 WO disclosed
US-20240239797-A1 AKT1 MODULATORS ALTEROME THERAPEUTICS, INC. 2024-07-18 US disclosed
US-11999730-B1 AKT1 modulators ALTEROME THERAPEUTICS, INC. (US) 2024-06-04 US disclosed
US-20090306041-A1 Inhibitors of Bruton's tyrosine kinase ROCHE PALO ALTO LLC 2009-12-10 US disclosed
US-20090306041-A1 Inhibitors of Bruton's tyrosine kinase ROCHE PALO ALTO LLC 2009-12-10 US disclosed
US-20090306041-A1 Inhibitors of Bruton's tyrosine kinase ROCHE PALO ALTO LLC 2009-12-10 US disclosed
US-7595316-B2 Heteroaryloxy nitrogenous saturated heterocyclic derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-09-29 US disclosed
US-20090137576-A1 Novel Piperidine Derivative MSD K.K. (JP) 2009-05-28 US disclosed
US-20080269287-A1 Substituted Pyridone Derivative MSD K.K. (JP) 2008-10-30 US disclosed
EP-1892241-A1 NOVEL PIPERIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-02-27 EP disclosed
EP-1820797-A1 SUBSTITUTED PYRIDONE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-22 EP disclosed
US-20060178375-A1 Heteroaryloxy nitrogenous saturated heterocyclic derivative MSD K.K. (JP) 2006-08-10 US disclosed
EP-1642898-A1 HETEROARYLOXY NITROGENOUS SATURATED HETEROCYCLIC DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-04-05 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 (10 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-20240239797-A1 AKT1 MODULATORS AKT1S1, AKT1, AKT2 PTGS2 3989/4885CREBBP 508/4885ALDH1A1 4692/4885
US-20250304577-A1 TYK2 INHIBITORS TYK2, JAK2, JAK1 PTGS2 2866/4885CREBBP 2527/4885ALDH1A1 4708/4885
US-20090137576-A1 Novel Piperidine Derivative HRH4, HRH3, HRH1 PTGS2 2134/4885CREBBP 1082/4885ALDH1A1 1242/4885
US-20080269287-A1 Substituted Pyridone Derivative HRH3, HRH4, HRH1 PTGS2 1703/4885CREBBP 3902/4885ALDH1A1 596/4885
US-20060178375-A1 Heteroaryloxy nitrogenous saturated heterocyclic derivative HRH3, HRH4, HCRTR2 PTGS2 1604/4885CREBBP 1601/4885ALDH1A1 3756/4885
US-20240360157-A1 TYK2 INHIBITORS TYK2, JAK2, ABL1 PTGS2 2767/4885CREBBP 3008/4885ALDH1A1 4716/4885
US-20240374606-A1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER PDXK, PGK1, PGK2 PTGS2 985/4885CREBBP 444/4885ALDH1A1 1591/4885
US-20250092040-A1 AKT1 MODULATORS AKT1S1, AKT1, AKT2 PTGS2 3989/4885CREBBP 508/4885ALDH1A1 4692/4885
US-11999730-B1 AKT1 modulators AKT1S1, AKT1, AKT2 PTGS2 3989/4885CREBBP 508/4885ALDH1A1 4692/4885
US-20090306041-A1 Inhibitors of Bruton's tyrosine kinase BTK, SYK, LYN PTGS2 1907/4885CREBBP 1131/4885ALDH1A1 4646/4885

“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.