SCHEMBL624941

SCHEMBL624941

CS(=O)(=O)N(c1ccccc1)S(=O)(=O)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 1/20 0.38
NR1H3 Q13133 3/20 0.36
NR3C2 P08235 1/20 0.36
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
PTPN1 P18031 2/20 0.35
RECQL P46063 1/20 0.35
CA9 Q16790 3/20 0.34
CA2 P00918 2/20 0.34
CA1 P00915 1/20 0.34
CA5A P35218 1/20 0.34
CA12 O43570 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPC1 O15118 1/20 0.34
POLB P06746 1/20 0.34
MLYCD O95822 1/20 0.34
PER2 O15055 1/20 0.34
CRY1 Q16526 1/20 0.34

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
SCHEMBL64494 0.88 CA2 (0.43) KMT2AMEN1ALDH1A1NR1H3PTGS1
SCHEMBL15082546 0.84 ALDH1A1 (0.37) KMT2AMEN1ALDH1A1NR1H3PTGS1
SCHEMBL2513199 0.81 NR3C2 (0.44) KMT2AMEN1ALDH1A1NR3C2CA9
SCHEMBL16300054 0.78 MEN1 (0.33) KMT2AMEN1ALDH1A1NR1H3PTGS1
SCHEMBL10059165 0.78 HSP90AA1 (0.36) KMT2AMEN1ALDH1A1NR1H3PTGS1
SCHEMBL17464348 0.78 NR3C2 (0.39) KMT2AMEN1ALDH1A1NR3C2PTPN1
SCHEMBL11512437 0.78 KMT2A (0.36) KMT2AMEN1ALDH1A1NR1H3NR3C2
SCHEMBL29279172 0.77 ALDH1A1 (0.33) KMT2AMEN1ALDH1A1NR1H3PTGS1
SCHEMBL6191256 0.77 GRM2 (0.39) KMT2AMEN1ALDH1A1
SCHEMBL28384073 0.77 CA2 (0.35) KMT2AMEN1ALDH1A1NR1H3PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003002548-A1 A PROCESS FOR THE PREPARATION OF CHIRAL GLUCOCORTICOID RECEPTOR AGENTS ABBOTT LABORATORIES (US) 2003-01-09 WO claimed
EP-4680612-A1 CHEMICAL COMPOUNDS AN2 Therapeutics, Inc. (US) 2026-01-21 EP disclosed
EP-4434990-A1 HETEROCYCLIC AND HETEROARYL COMPOUNDS FOR TREATING HUNTINGTON'S DISEASE PTC Therapeutics, Inc. (US) 2024-09-25 EP disclosed
WO-2024192309-A1 CHEMICAL COMPOUNDS REACTIVE BIOSCIENCES, INC. (US) 2024-09-19 WO disclosed
US-20240218013-A1 Process for the preparation of B-[(7alpha,17beta)-17-hydroxy-7-[9-[(4,4,5,5,5-pentafluoropentyl) sulfinyl]nonyl]estra-1,3,5(10)-trien-3-yl]-boronic acid and intermediates of said process INDUSTRIALE CHIMICA S.R.L. (IT) 2024-07-04 US disclosed
WO-2024080788-A1 NOVEL TRICYCLIC DERIVATIVE COMPOUND AND USES THEREOF 한미약품 주식회사 2024-04-18 WO disclosed
WO-2024009325-A1 Solid state forms of 6-(2-hydroxy-2-methylpropoxy)-4-(6-(6-((6-methoxypyridin-3-yl)methyl)-3,6-diazabicyclo[3.1.1]heptan-3-yl)pyridin-3-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile and processes for preparation thereof MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) 2024-01-11 WO disclosed
US-11805697-B2 Organic electroluminescence device and monoamine compound for organic electroluminescence device SAMSUNG DISPLAY CO., LTD. (KR) 2023-10-31 US disclosed
US-20230331681-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR ARVINAS OPERATIONS, INC. 2023-10-19 US disclosed
US-11713313-B2 GLS1 inhibitors for treating disease BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-08-01 US disclosed
US-20120231543-A1 NOVEL OPIOID ANTAGONISTS ADOLOR CORPORATION (US) 2012-09-13 US disclosed
WO-2012071458-A1 HETEROCYCLIC INHIBITORS OF BETA - SECRETASE FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES ARRAY BIOPHARMA INC. (US) 2012-05-31 WO disclosed
WO-2012019954-A1 PYRAZOLOPYRIDINE COMPOUNDS AS PDE10A INHIBITORS EVOTEC (UK) LTD. (GB) 2012-02-16 WO disclosed
EP-2271625-A2 TETRAHYDROISOQUINOLINES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY Abbott GmbH & Co. KG (DE) 2011-01-12 EP disclosed
WO-2009130232-A1 PYRAZOLO [1, 5 -A] PYRAZINE DERIVATIVES AS ANTAGONISTS OF V1B RECEPTORS GLAXO GROUP LIMITED (GB) 2009-10-29 WO disclosed
WO-2009121872-A2 TETRAHYDROISOQUINOLINES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY ABBOTT GMBH & CO. KG (DE) 2009-10-08 WO disclosed
US-20090221562-A1 NOVEL OPIOID ANTAGONISTS ADOLOR CORPORATION (US) 2009-09-03 US disclosed
US-20090221562-A1 NOVEL OPIOID ANTAGONISTS ADOLOR CORPORATION (US) 2009-09-03 US disclosed
EP-1513793-A1 NOVEL LIGANDS THAT ARE INHIBITORS OF THE RAR RECEPTORS, PROCESS FOR PREPARING THEM AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS Galderma Research & Development, S.N.C. (FR) 2005-03-16 EP disclosed
WO-2003101928-A1 NOVEL LIGANDS THAT ARE INHIBITORS OF THE RAR RECEPTORS, PROCESS FOR PREPARING THEM AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2003-12-11 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 (6 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-20120231543-A1 NOVEL OPIOID ANTAGONISTS OPRK1, OPRM1, OPRL1 KMT2A 2033/4885MEN1 4879/4885ALDH1A1 761/4885
US-20240218013-A1 Process for the preparation of B-[(7alpha,17beta)-17-hydroxy-7-[9-[(4,4,5,5,5-pentafluoropentyl) sulfinyl]nonyl]estra-1,3,5(10)-trien-3-yl]-boronic acid and intermediates of said process CYP19A1, HSD17B11, NR5A1 KMT2A 1601/4885MEN1 1327/4885ALDH1A1 1682/4885
US-20230331681-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AR, ADRM1, CRBN KMT2A 1463/4885MEN1 1674/4885ALDH1A1 798/4885
US-20090221562-A1 NOVEL OPIOID ANTAGONISTS OPRK1, OPRM1, OPRL1 KMT2A 2033/4885MEN1 4879/4885ALDH1A1 761/4885
US-11805697-B2 Organic electroluminescence device and monoamine compound for organic electroluminescence device SLC18A2, SLC18A1, MAOA KMT2A 1302/4885MEN1 2341/4885ALDH1A1 89/4885
US-11713313-B2 GLS1 inhibitors for treating disease GLS2, GLS, GLG1 KMT2A 2651/4885MEN1 1849/4885ALDH1A1 882/4885

“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.