SCHEMBL656796

SCHEMBL656796

Nc1cccc(SC(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.56
TDP1 Q9NUW8 3/20 0.56
KDM4E B2RXH2 2/20 0.56
TSHR P16473 4/20 0.48
MAPK1 P28482 2/20 0.48
CYP3A4 P08684 2/20 0.46
CASP1 P29466 1/20 0.46
RECQL P46063 1/20 0.46
LMNA P02545 2/20 0.44
MAPT P10636 1/20 0.44
HTT P42858 1/20 0.44
KCNH2 Q12809 1/20 0.42
CA12 O43570 1/20 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
CA14 Q9ULX7 1/20 0.38
MAOA P21397 1/20 0.37
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL29574292 1.00 ALDH1A1 (0.56) ALDH1A1TDP1KDM4ETSHRMAPK1
SCHEMBL25118322 0.80 TSHR (0.42) ALDH1A1TDP1KDM4ETSHRMAPK1
SCHEMBL1359660 0.80 TSHR (0.42) ALDH1A1TDP1KDM4ETSHRMAPK1
SCHEMBL5313141 0.78 CYP3A4 (0.46) ALDH1A1TDP1KDM4ETSHRMAPK1
SCHEMBL24265413 0.78 TRPV1 (0.43) ALDH1A1TDP1KDM4ETSHRMAPK1
Hydrochloric Acid SCHEMBL27555401 0.77 HSD17B10 (0.44) ALDH1A1TDP1KDM4ETSHRMAPK1
SCHEMBL5671151 0.77 MAOB (0.59) CYP3A4PTPRZ1
SCHEMBL25416404 0.76 KDM4E (0.41) ALDH1A1TDP1KDM4ETSHRMAPK1
SCHEMBL514154 0.76 KDM4E (0.41) ALDH1A1TDP1KDM4ETSHRMAPK1
SCHEMBL9680787 0.75 KDM4E (0.52) ALDH1A1TDP1KDM4ETSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10991972-B2 Electrolyte solution, positive electrode, and lithium-ion battery comprising the electrolyte solution and/or the positive electrode BYD COMPANY LIMITED (CN) 2021-04-27 US claimed
US-20190036156-A1 ELECTROLYTE SOLUTION, POSITIVE ELECTRODE, AND LITHIUM-ION BATTERY COMPRISING THE ELECTROLYTE SOLUTION AND/OR THE POSITIVE ELECTRODE BYD COMPANY LIMITED (CN) 2019-01-31 US claimed
EP-3407416-A1 ELECTROLYTIC SOLUTION, POSITIVE ELECTRODE, AND LITHIUM-ION BATTERY CONTAINING THE ELECTROLYTIC SOLUTION AND/OR THE POSITIVE ELECTRODE BYD Company Limited (CN) 2018-11-28 EP claimed
US-20100166765-A1 BENZOQUINAZOLINE DERIVATIVES NOVARTIS AG (CH) 2010-07-01 US claimed
US-20100041657-A1 HALOALKYLSULFONE SUBSTITUTED COMPOUNDS USEFUL FOR TREATING OBESITY AND DIABETES NOVO NORDICK A/S (DK) 2010-02-18 US claimed
EP-1917246-B1 BENZOQUINAZOLINE DERIVATIVES AND THEIR USE IN TREATING BONE DISORDERS NOVARTIS AG (CH) 2009-11-11 EP claimed
EP-1917246-A1 BENZOQUINAZOLINE DERIVATIVES AND THEIR USE IN TREATING BONE DISORDERS Novartis AG (CH) 2008-05-07 EP claimed
EP-1881961-A1 NEW HALOALKYLSULFONE SUBSTITUTED COMPOUNDS USEFUL FOR TREATING OBESITY AND DIABETES NOVO NORDISK A/S (DK) 2008-01-30 EP claimed
WO-2007020046-A1 BENZOQUINAZOLINE DERIVATIVES AND THEIR USE IN TREATING BONE DISORDERS NOVARTIS AG (CH) 2007-02-22 WO claimed
WO-2006120178-A1 NEW HALOALKYLSULFONE SUBSTITUTED COMPOUNDS USEFUL FOR TREATING OBESITY AND DIABETES NOVO NORDISK A/S (DK) 2006-11-16 WO claimed
WO-2026098560-A2 BENZENE-CONTAINING POLYCYCLIC DERIVATIVE MODULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2026-05-15 WO disclosed
US-20260047580-A1 HETEROCYCLIC COMPOUND AND HARMFUL ARTHROPOD PEST CONTROL COMPOSITION CONTAINING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2026-02-19 US disclosed
EP-4661964-A1 COMPOUNDS AS CCR6 INHIBITORS F. Hoffmann-La Roche AG (CH) 2025-12-17 EP disclosed
US-12478067-B2 Heterocyclic compound and harmful arthropod pest control composition containing same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2025-11-25 US disclosed
US-20250353859-A1 COMPOUNDS AS CCR6 INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2025-11-20 US disclosed
EP-0000156-B1 2-ARYLAMINO-3,5-DINITRO-BENZOTRIFLUORIDES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS PESTICIDES. BAYER AG (DE) 1980-11-12 EP disclosed
EP-0010420-A1 Pyridyl-substituted thiazolidine and 1,3-thiazine derivatives, processes for their preparation, agricultural compositions containing said derivatives and methods for regulating plant growth and protecting plants from fungi ELI LILLY AND COMPANY (US) 1980-04-30 EP disclosed
EP-0000156-A1 2-Arylamino-3,5-dinitro-benzotrifluorides, process for their preparation and their use as pesticides. BAYER AG (DE) 1979-01-10 EP disclosed
US-4031094-A ANOREXIGEN AND ANXIOLYTIC AGENTS SYNTHELABO (FR) 1977-06-21 US disclosed
US-3954763-A N-Metatrifluoromethylthiophenyl-piperazine SYNTHELABO (FR) 1976-05-04 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 (5 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-20100041657-A1 HALOALKYLSULFONE SUBSTITUTED COMPOUNDS USEFUL FOR TREATING OBESITY AND DIABETES RPS12, GPR119, ATP12A ALDH1A1 899/4885TDP1 4073/4885KDM4E 2679/4885
US-20100166765-A1 BENZOQUINAZOLINE DERIVATIVES CACNA1A, BMP4, TPX2 ALDH1A1 3966/4885TDP1 2316/4885KDM4E 274/4885
US-12478067-B2 Heterocyclic compound and harmful arthropod pest control composition containing same C5, COX6C, C1S ALDH1A1 1268/4885TDP1 4362/4885KDM4E 1825/4885
US-20260047580-A1 HETEROCYCLIC COMPOUND AND HARMFUL ARTHROPOD PEST CONTROL COMPOSITION CONTAINING SAME COX6C, COX6B1, CYC1 ALDH1A1 1905/4885TDP1 4277/4885KDM4E 2265/4885
US-20250353859-A1 COMPOUNDS AS CCR6 INHIBITORS CCR6, CCR4, CCR1 ALDH1A1 3366/4885TDP1 2592/4885KDM4E 1467/4885

“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.