SCHEMBL817545

SCHEMBL817545

Cc1ccc(S(F)(F)(F)(F)F)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACHE P22303 6/20 0.50
TDP1 Q9NUW8 1/20 0.50
PDE2A O00408 3/20 0.48
ALDH1A1 P00352 3/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
KDM1A O60341 1/20 0.38
MAPT P10636 1/20 0.38
TSHR P16473 3/20 0.35
LMNA P02545 2/20 0.35
ALOX12 P18054 1/20 0.35
NFE2L2 Q16236 1/20 0.35
IDO1 P14902 1/20 0.33

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
SCHEMBL22795543 0.92 PDE2A (0.43) ACHETDP1PDE2AALDH1A1CA1
SCHEMBL17651164 0.85 NFE2L2 (0.58) PDE2ACA1MAPTLMNANFE2L2
SCHEMBL17431633 0.85 NFE2L2 (0.58) PDE2ACA1MAPTLMNANFE2L2
SCHEMBL1970199 0.83 PDE2A (0.52) PDE2AKDM1A
SCHEMBL12353980 0.77 ACHE (0.44) ACHETDP1PDE2AALDH1A1CA1
SCHEMBL26496096 0.77 ACHE (0.44) ACHETDP1ALDH1A1CA1CA2
P-Xylene SCHEMBL3847044 0.75
SCHEMBL19665045 0.75 RXRA (0.45) ACHEPDE2AALDH1A1KDM1ATSHR
SCHEMBL4621106 0.75 CYP1A2 (0.59) TDP1PDE2AALDH1A1CA9MAPT
SCHEMBL17431626 0.73 PDE2A (0.46) TDP1PDE2AALDH1A1KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110301382-A1 Processes for Preparing 1,3-Dinitro-5-(Pentafluorosulfanyl)Benzene and its Intermediates UBE INDUSTRIES, LTD. (JP) 2011-12-08 US claimed
EP-4595143-A1 TERNARY SOLVENT ELECTROLYTES FOR HIGH VOLTAGE AND HIGH RATE LITHIUM BATTERIES Sepion Technologies, Inc. (US) 2025-08-06 EP disclosed
CN-120202571-A Ternary solvent electrolyte for high voltage and high rate lithium battery 赛鹏科技有限公司 2025-06-24 CN disclosed
US-12172980-B2 Compounds as neuronal histamine receptor-3 antagonists and uses thereof XWPharma Ltd. (KY) 2024-12-24 US disclosed
WO-2024073410-A1 TERNARY SOLVENT ELECTROLYTES FOR HIGH VOLTAGE AND HIGH RATE LITHIUM BATTERIES SEPION TECHNOLOGIES, INC. (US) 2024-04-04 WO disclosed
WO-2024017977-A1 IMIDAZOPYRIDINE COMPOUNDS, PREPARATION THEREOF AND THERAPEUTIC USES THEREOF SANOFI (FR) 2024-01-25 WO disclosed
WO-2024003259-A1 TEAD INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2024-01-04 WO disclosed
US-11820767-B2 Benzyl amine-containing heterocyclic compounds and compositions useful against mycobacterial infection UNIVERSITY OF NOTRE DAME DU LAC (US) 2023-11-21 US disclosed
CN-116940551-A Method for producing aryl compound containing pentafluorothio group AGC株式会社 2023-10-24 CN disclosed
EP-4260704-A1 ANTIMICROBIAL COMPOSITIONS COMPRISING A PHENYL UREA COMPOUND AND A CIS-UNSATURATED FATTY ACID WITH 16 TO 22 CARBON ATOMS National Taiwan University (TW) 2023-10-18 EP disclosed
US-7608604-B2 Antiparasitic agents PFIZER LIMITED (GB) 2009-10-27 US disclosed
US-20090264525-A1 FLUOROSURFACTANTS MERCK PATENT GMBH (DE) 2009-10-22 US disclosed
US-7592491-B2 Process for producing arylsulfur pentafluorides IM&T RESEARCH, INC. (US) 2009-09-22 US disclosed
US-7592491-B2 Process for producing arylsulfur pentafluorides IM&T RESEARCH, INC. (US) 2009-09-22 US disclosed
US-20090203667-A1 PENTADIENAMIDE DERIVATIVES KYOWA HAKKO KIRIN CO., LTD. (JP) 2009-08-13 US disclosed
US-20090197201-A1 FLUOROSURFACTANTS MERCK PATENT GESELLSCHAFT (DE) 2009-08-06 US disclosed
WO-2008118787-A1 PROCESS FOR PRODUCING ARYLSULFUR PENTAFLUORIDES IM & T RESEARCH, INC. (US) 2008-10-02 WO disclosed
US-20080234520-A1 PROCESS FOR PRODUCING ARYLSULFUR PENTAFLUORIDES IM&T RESEARCH, INC. (US) 2008-09-25 US disclosed
US-20080234520-A1 PROCESS FOR PRODUCING ARYLSULFUR PENTAFLUORIDES IM&T RESEARCH, INC. (US) 2008-09-25 US disclosed
US-20080194694-A1 nematocides such as N-{1-cyano-2-[5-cyano-2-(trifluoromethyl)phenoxy]-1-methylethyl}-4-pentafluorothiobenzamide, tautomers or prodrugs, carriers and optionally a second therapeutic agent, used for treating parasitic infestations PFIZER LIMITED (UK) 2008-08-14 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 (8 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-11820767-B2 Benzyl amine-containing heterocyclic compounds and compositions useful against mycobacterial infection BET1, BRD4, BRD3 ACHE 3100/4885TDP1 3498/4885PDE2A 2367/4885
US-20080194694-A1 nematocides such as N-{1-cyano-2-[5-cyano-2-(trifluoromethyl)phenoxy]-1-methylethyl}-4-pentafluorothiobenzamide, tautomers or prodrugs, carriers and optionally a second therapeutic agent, used for treating parasitic infestations HRH4, HRH3, HRH2 ACHE 441/4885TDP1 2006/4885PDE2A 3598/4885
US-12172980-B2 Compounds as neuronal histamine receptor-3 antagonists and uses thereof HRH3, HRH4, HRH2 ACHE 351/4885TDP1 4538/4885PDE2A 1600/4885
US-20080234520-A1 PROCESS FOR PRODUCING ARYLSULFUR PENTAFLUORIDES PFAS, MPST, ARSA ACHE 3969/4885TDP1 4179/4885PDE2A 4546/4885
US-20090203667-A1 PENTADIENAMIDE DERIVATIVES PRMT1, REN, NGLY1 ACHE 1750/4885TDP1 2689/4885PDE2A 1303/4885
US-20090264525-A1 FLUOROSURFACTANTS FASN, FFAR3, SGMS2 ACHE 4537/4885TDP1 4827/4885PDE2A 3945/4885
US-20110301382-A1 Processes for Preparing 1,3-Dinitro-5-(Pentafluorosulfanyl)Benzene and its Intermediates DPYD, FDPS, BLVRB ACHE 3143/4885TDP1 1727/4885PDE2A 4133/4885
US-20090197201-A1 FLUOROSURFACTANTS CBR3, SCO2, FPR3 ACHE 3633/4885TDP1 4231/4885PDE2A 3630/4885

“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.