SCHEMBL7772037

SCHEMBL7772037

FC(c1ccccc1)C(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.39
TSHR P16473 2/20 0.39
F2 P00734 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HTR2A P28223 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
ACP3 P15309 1/20 0.35
CYP2D6 P10635 1/20 0.35
SRC P12931 1/20 0.35
CACNA1F O60840 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
ADRA2B P18089 1/20 0.34
CHRM3 P20309 1/20 0.34
ADRA1A P35348 1/20 0.34
HRH1 P35367 1/20 0.34
OPRK1 P41145 1/20 0.34
CACNA1D Q01668 1/20 0.34
SLC6A3 Q01959 1/20 0.34
KCNH2 Q12809 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
SCHEMBL28933413 0.85 KIF11 (0.48) ALDH1A1TAAR1ACP3
SCHEMBL28933407 0.80 LTA4H (0.48) TSHR
SCHEMBL28774583 0.79 SLC6A4 (0.41) DPP4TSHRF2ALDH1A1ACP3
SCHEMBL7870015 0.79 POLB (0.39) DPP4TSHRF2ALDH1A1HTR2A
SCHEMBL16428390 0.79 PTPN1 (0.38) DPP4TSHRF2ALDH1A1ACP3
SCHEMBL30204365 0.78 ESR1 (0.39) TSHR
SCHEMBL28443758 0.78 TSHR (0.46) DPP4TSHRF2HTR2ATAAR1
SCHEMBL9778287 0.77 TSHR (0.40) DPP4TSHRF2ALDH1A1HTR2A
SCHEMBL21834945 0.77 TSHR (0.46) DPP4TSHRF2ALDH1A1ACP3
SCHEMBL10213399 0.76 SLC6A4 (0.42) DPP4TSHRF2TAAR1CACNA1F

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112830862-B Novel fluorine-containing flame retardant, synthetic method and application thereof in nylon 6 modification 三明学院 2023-04-18 CN claimed
CN-112830862-A Novel fluorine-containing flame retardant, synthetic method and application thereof in nylon 6 modification 三明学院 2021-05-25 CN claimed
EP-2951179-B1 SPIRO-QUINAZOLINONE DERIVATIVES USEFUL FOR THE TREATMENT OF NEUROLOGICAL DISEASES AND CONDITIONS MERCK PATENT GMBH (DE) 2020-03-11 EP claimed
US-9708321-B2 Spiro-quinazolinone derivatives and their use as positive allosteric modulators of mGluR4 MERCK PATENT GMBH (DE) 2017-07-18 US claimed
US-20150361079-A1 Spiro-Quinazolinone Derivatives and their Use as Positive Allosteric Modulators of mGluR4 MERCK PATENT GMBH (DE) 2015-12-17 US claimed
EP-2951179-A1 SPIRO-QUINAZOLINONE DERIVATIVES USEFUL FOR THE TREATMENT OF NEUROLOGICAL DISEASES AND CONDITIONS Merck Patent GmbH (DE) 2015-12-09 EP claimed
CN-104955826-A SPIRO-QUINAZOLINONE DERIVATIVES USEFUL FOR THE TREATMENT OF NEUROLOGICAL DISEASES AND CONDITIONS MERCK PATENT GMBH 2015-09-30 CN claimed
WO-2014117920-A1 SPIRO-QUINAZOLINONE DERIVATIVES USEFUL FOR THE TREATMENT OF NEUROLOGICAL DISEASES AND CONDITIONS MERCK PATENT GMBH (DE) 2014-08-07 WO claimed
EP-1119536-A1 NOVEL BROMINE-CONTAINING 1,2-BIS(PHENYL) TETRAFLUORO ETHANES AND METHOD OF IMPARTING FLAME RETARDANCY TO FLAMMABLE MATERIALS Great Lakes Chemical Corporation (US) 2001-08-01 EP claimed
WO-2000020363-A1 NOVEL BROMINE-CONTAINING 1,2-BIS(PHENYL) TETRAFLUORO ETHANES AND METHOD OF IMPARTING FLAME RETARDANCY TO FLAMMABLE MATERIALS GREAT LAKES CHEMICAL CORPORATION (US) 2000-04-13 WO claimed
CN-112830862-B Novel fluorine-containing flame retardant, synthetic method and application thereof in nylon 6 modification 三明学院 2023-04-18 CN disclosed
CN-112830862-B Novel fluorine-containing flame retardant, synthetic method and application thereof in nylon 6 modification 三明学院 2023-04-18 CN disclosed
US-20220221619-A1 MATERIALS FOR FORMING A NUCLEATION-INHIBITING COATING AND DEVICES INCORPORATING SAME OTI LUMIONICS INC. (CA) 2022-07-14 US disclosed
CN-112830862-A Novel fluorine-containing flame retardant, synthetic method and application thereof in nylon 6 modification 三明学院 2021-05-25 CN disclosed
CN-112830862-A Novel fluorine-containing flame retardant, synthetic method and application thereof in nylon 6 modification 三明学院 2021-05-25 CN disclosed
WO-2014117920-A1 SPIRO-QUINAZOLINONE DERIVATIVES USEFUL FOR THE TREATMENT OF NEUROLOGICAL DISEASES AND CONDITIONS MERCK PATENT GMBH (DE) 2014-08-07 WO disclosed
EP-1119536-A1 NOVEL BROMINE-CONTAINING 1,2-BIS(PHENYL) TETRAFLUORO ETHANES AND METHOD OF IMPARTING FLAME RETARDANCY TO FLAMMABLE MATERIALS Great Lakes Chemical Corporation (US) 2001-08-01 EP disclosed
WO-2000020363-A1 NOVEL BROMINE-CONTAINING 1,2-BIS(PHENYL) TETRAFLUORO ETHANES AND METHOD OF IMPARTING FLAME RETARDANCY TO FLAMMABLE MATERIALS GREAT LAKES CHEMICAL CORPORATION (US) 2000-04-13 WO disclosed
EP-0822459-A1 Electrostatic image developing toner HODOGAYA CHEMICAL CO LTD (JP) 1998-02-04 EP disclosed
US-5693445-A CONSISTS OF A POLYMERIC BINDER, COLORANT AND XANTHENE-TYPE DYE AS CHARGE CONTROL AGENT HODOGAYA CHEMICAL CO., LTD. (JP) 1997-12-02 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 (1 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-20150361079-A1 Spiro-Quinazolinone Derivatives and their Use as Positive Allosteric Modulators of mGluR4 GRM4, GRIA4, GRIK4 DPP4 778/4885TSHR 839/4885F2 4883/4885

“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.