SCHEMBL51098

SCHEMBL51098

NS(=O)(=O)Cc1ccccc1F

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
KMT2A Q03164 3/20 0.51
ALDH1A1 P00352 3/20 0.51
MEN1 O00255 2/20 0.51
CA1 P00915 4/20 0.50
CA2 P00918 4/20 0.50
CA9 Q16790 2/20 0.50
TAAR1 Q96RJ0 2/20 0.50
CA5A P35218 1/20 0.50
IDO1 P14902 2/20 0.47
AKR1B1 P15121 1/20 0.46
ALOX5AP P20292 1/20 0.43
FEN1 P39748 1/20 0.43
AOC3 Q16853 1/20 0.41
GAA P10253 1/20 0.40
RECQL P46063 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CA12 O43570 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
SCHEMBL30409980 1.00 LMNA (0.52) LMNAKMT2AALDH1A1MEN1CA1
Hydrochloric Acid SCHEMBL20502511 0.98 LMNA (0.50) LMNAKMT2AALDH1A1MEN1CA1
SCHEMBL3329020 0.83 AKR1B1 (0.49) LMNAKMT2AALDH1A1MEN1CA1
SCHEMBL777513 0.82 ALDH1A1 (0.65) LMNAKMT2AALDH1A1MEN1TAAR1
SCHEMBL29468654 0.82 ALDH1A1 (0.65) LMNAKMT2AALDH1A1MEN1TAAR1
SCHEMBL4881602 0.80 CA1 (0.39) LMNAKMT2AALDH1A1MEN1CA1
SCHEMBL3601572 0.80 CA1 (0.46) LMNAKMT2AALDH1A1MEN1CA1
SCHEMBL5489643 0.79 LMNA (0.53) LMNAKMT2AALDH1A1MEN1CA1
SCHEMBL4881315 0.79 TAAR1 (0.57) LMNAKMT2AALDH1A1MEN1CA1
SCHEMBL785189 0.78 LMNA (0.52) LMNAKMT2AALDH1A1MEN1TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220153734-A1 Pyrazolopyridine Compounds For IRE1 Inhibition Optikira, LLC 2022-05-19 US claimed
US-20240336590-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH APJ RECEPTOR ACTIVITY ANNAPURNA BIO, INC. 2024-10-10 US disclosed
US-12071425-B2 Phenoxy-pyridyl-pyrimidine compounds and methods of use GENENTECH, INC. (US) 2024-08-27 US disclosed
US-20230331719-A1 Pyrazolopyridine Compounds and Methods of Inhibiting IRE1 Using Same OPTIKIRA LLC (US) 2023-10-19 US disclosed
US-11724997-B2 Compounds and compositions for treating conditions associated with APJ receptor activity ANNAPURNA BIO, INC. (US) 2023-08-15 US disclosed
US-11724997-B2 Compounds and compositions for treating conditions associated with APJ receptor activity ANNAPURNA BIO, INC. (US) 2023-08-15 US disclosed
US-11724997-B2 Compounds and compositions for treating conditions associated with APJ receptor activity ANNAPURNA BIO, INC. (US) 2023-08-15 US disclosed
US-20230057166-A1 PHENOXY-PYRIDYL-PYRIMIDINE COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2023-02-23 US disclosed
US-20220153734-A1 Pyrazolopyridine Compounds For IRE1 Inhibition Optikira, LLC 2022-05-19 US disclosed
CN-113508115-A Pyridopyrimidinone and pteridinone compounds as inhibitors of endoribonuclease inositol requiring enzyme I (IRE I A) for the treatment of cancer diseases 基因泰克公司 2021-10-15 CN disclosed
EP-2044050-A1 NEW PYRIDINE ANALOGUES Astra Zeneca AB (SE) 2009-04-08 EP disclosed
US-20080312208-A1 Pyridine Analogues ASTRAZENECA AB (SE) 2008-12-18 US disclosed
US-20080176827-A1 New Pyridine Analogues VII 543 ASTRAZENECA AB (SE) 2008-07-24 US disclosed
US-20080171732-A1 New Pyridine Analogues IX 519 ASTRAZENECA AB (SE) 2008-07-17 US disclosed
WO-2008085117-A1 PYRIDINE COMPOUNDS AND THEIR USE AS P2Y12 ANTAGONISTS. ASTRAZENECA AB (SE) 2008-07-17 WO disclosed
WO-2008085118-A1 PYRIDINE COMPOUNDS AND THEIR USE AS P2Y12 ANTAGONISTS. ASTRAZENECA AB (SE) 2008-07-17 WO disclosed
EP-1904474-A1 NEW PYRIDINE ANALOGUES AstraZeneca AB (SE) 2008-04-02 EP disclosed
US-20080039437-A1 New Pyridine Analogues III ASTRAZENECA AB (SE) 2008-02-14 US disclosed
WO-2008004946-A1 NEW PYRIDINE ANALOGUES ASTRAZENECA AB (SE) 2008-01-10 WO disclosed
WO-2007008140-A1 NEW PYRIDINE ANALOGUES ASTRAZENECA AB (SE) 2007-01-18 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 (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-20080176827-A1 New Pyridine Analogues VII 543 P2RY12, P2RY11, P2RY4 LMNA 1707/4885KMT2A 4572/4885ALDH1A1 1634/4885
US-11724997-B2 Compounds and compositions for treating conditions associated with APJ receptor activity APLNR, AGTR1, AGTR2 LMNA 1886/4885KMT2A 2897/4885ALDH1A1 2778/4885
US-20230057166-A1 PHENOXY-PYRIDYL-PYRIMIDINE COMPOUNDS AND METHODS OF USE XBP1, ERN1, ESR2 LMNA 1725/4885KMT2A 4415/4885ALDH1A1 2362/4885
US-20080171732-A1 New Pyridine Analogues IX 519 P2RY12, P2RY11, P2RY1 LMNA 1346/4885KMT2A 4487/4885ALDH1A1 1518/4885
US-20080039437-A1 New Pyridine Analogues III P2RY12, P2RY1, P2RY11 LMNA 1709/4885KMT2A 4378/4885ALDH1A1 1928/4885
US-12071425-B2 Phenoxy-pyridyl-pyrimidine compounds and methods of use XBP1, ERN1, ESR2 LMNA 1725/4885KMT2A 4415/4885ALDH1A1 2362/4885
US-20240336590-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH APJ RECEPTOR ACTIVITY APLNR, AGTR1, AGTR2 LMNA 1886/4885KMT2A 2897/4885ALDH1A1 2778/4885
US-20230331719-A1 Pyrazolopyridine Compounds and Methods of Inhibiting IRE1 Using Same XBP1, ERN1, ERN2 LMNA 1309/4885KMT2A 3798/4885ALDH1A1 2570/4885
US-20080312208-A1 Pyridine Analogues P2RY12, P2RY11, P2RY1 LMNA 1509/4885KMT2A 3584/4885ALDH1A1 1274/4885
US-20220153734-A1 Pyrazolopyridine Compounds For IRE1 Inhibition XBP1, ERN1, ERN2 LMNA 1449/4885KMT2A 3650/4885ALDH1A1 2438/4885

“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.