SCHEMBL979567

SCHEMBL979567

FC(F)(F)c1cc(Cl)cc(I)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.41
AHR P35869 1/20 0.39
NOTUM Q6P988 1/20 0.38
TSHR P16473 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP3A4 P08684 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
HIF1A Q16665 1/20 0.36
TXNRD1 Q16881 1/20 0.36
TXNRD3 Q86VQ6 1/20 0.36
TXNRD2 Q9NNW7 1/20 0.36
SLC13A3 Q8WWT9 1/20 0.36
CES2 O00748 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 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
SCHEMBL30074438 1.00 RAPGEF4 (0.41) RAPGEF4AHRNOTUMTSHRTDP1
SCHEMBL15512406 0.82 CA1 (0.37) RAPGEF4AHRNOTUMTDP1ADORA2A
SCHEMBL321756 0.82 AHR (0.52) RAPGEF4AHRNOTUMTSHRTDP1
SCHEMBL81205 0.82 CES2 (0.46) RAPGEF4TSHRTDP1ALDH1A1CYP3A4
SCHEMBL3786224 0.82 RAPGEF4 (0.47) RAPGEF4AHRNOTUMTSHRTDP1
SCHEMBL2159227 0.82 CES2 (0.40) RAPGEF4TSHRTDP1ALDH1A1CYP3A4
Nitrogen SCHEMBL9592328 0.77 AHR (0.48) RAPGEF4AHRNOTUMTSHRTDP1
Nitrogen SCHEMBL28987389 0.75 AHR (0.47) RAPGEF4AHRNOTUMTSHRTDP1
SCHEMBL30074464 0.73 RXRA (0.36) TSHRALDH1A1CES2HDAC3HDAC1
SCHEMBL18260731 0.73 RXRA (0.36) TSHRALDH1A1CES2HDAC3HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105646215-B Process for the preparation of 3-trifluoromethyl chalcones 杜邦公司 2020-04-14 CN claimed
US-9938248-B2 Method for preparing 3-trifluoromethyl chalcones E.I. DU PONT DE NEMOURS AND COMPANY (US) 2018-04-10 US claimed
US-20180057468-A1 METHOD FOR PREPARING 3-TRIFLUOROMETHYL CHALCONES CORTEVA AGRISCIENCE LLC 2018-03-01 US claimed
EP-2706050-B1 1-Chloro-3-iodo-5-(trifluoromethyl)benzene DU PONT (US) 2016-08-31 EP claimed
US-20140155617-A1 METHOD FOR PREPARING 3-TRIFLUOROMETHYL CHALCONES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2014-06-05 US claimed
EP-2706050-A1 1-Chloro-3-iodo-5-(trifluoromethyl)benzene E. I. du Pont de Nemours and Company (US) 2014-03-12 EP claimed
US-20110009638-A1 METHOD FOR PREPARING 3-TRIFLUOROMETHYL CHALCONES E.I. DU PONT DE NEMOURS AND COMPANY (DE) 2011-01-13 US claimed
EP-2260016-A2 METHOD FOR PREPARING 3-TRIFLUOROMETHYL CHALCONES E. I. du Pont de Nemours and Company (US) 2010-12-15 EP claimed
WO-2009126668-A2 METHOD FOR PREPARING 3-TRIFLUOROMETHYL CHALCONES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2009-10-15 WO claimed
US-20250115576-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2025-04-10 US disclosed
US-12209075-B2 Pyridine-sulfonamide derivatives as sodium channel inhibitors GENENTECH, INC. (US) 2025-01-28 US disclosed
EP-4486453-A1 BENZAMIDE COMPOUNDS FOR TREATMENT OF BACTERIAL INFECTIONS F. Hoffmann-La Roche AG (CH) 2025-01-08 EP disclosed
CN-119176772-A Compound with Mrgpr X receptor inhibition effect and application thereof 博济医药科技股份有限公司 2024-12-24 CN disclosed
US-20240417389-A1 PYRIMIDINYL TYROSINE KINASE INHIBITORS OXFORD FINANCE LLC, AS COLLATERAL AGENT 2024-12-19 US disclosed
WO-2013185084-A1 PYRIMIDINYL TYROSINE KINASE INHIBITORS BIOGEN IDEC MA INC. (US) 2013-12-12 WO disclosed
US-8546618-B2 Method for preparing 3-trifluoromethyl chalcones E.I. DU PONT DE NEMOURS AND COMPANY (US) 2013-10-01 US disclosed
CN-101990530-A Process for the preparation of 3-trifluoromethyl chalcones DU PONT 2011-03-23 CN disclosed
US-20110009638-A1 METHOD FOR PREPARING 3-TRIFLUOROMETHYL CHALCONES E.I. DU PONT DE NEMOURS AND COMPANY (DE) 2011-01-13 US disclosed
EP-2260016-A2 METHOD FOR PREPARING 3-TRIFLUOROMETHYL CHALCONES E. I. du Pont de Nemours and Company (US) 2010-12-15 EP disclosed
WO-2009126668-A2 METHOD FOR PREPARING 3-TRIFLUOROMETHYL CHALCONES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2009-10-15 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-20140155617-A1 METHOD FOR PREPARING 3-TRIFLUOROMETHYL CHALCONES NR3C2, RAE1, SULT1E1 RAPGEF4 1026/4885AHR 2688/4885NOTUM 999/4885
US-20240417389-A1 PYRIMIDINYL TYROSINE KINASE INHIBITORS ABL1, BTK, ABL2 RAPGEF4 1108/4885AHR 3648/4885NOTUM 4170/4885
US-20180057468-A1 METHOD FOR PREPARING 3-TRIFLUOROMETHYL CHALCONES NR3C2, CYP4A11, RAE1 RAPGEF4 817/4885AHR 2262/4885NOTUM 1579/4885
US-20110009638-A1 METHOD FOR PREPARING 3-TRIFLUOROMETHYL CHALCONES NR3C2, CYP4A11, RAE1 RAPGEF4 817/4885AHR 2262/4885NOTUM 1579/4885
US-12209075-B2 Pyridine-sulfonamide derivatives as sodium channel inhibitors SCN1B, CACNA1A, SCN1A RAPGEF4 2483/4885AHR 3364/4885NOTUM 3757/4885
US-20250115576-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF F12, REN, ZYX RAPGEF4 2702/4885AHR 3950/4885NOTUM 2494/4885

“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.