SCHEMBL468053

SCHEMBL468053

FC(F)(F)c1ccc(-c2nccs2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.57
LOXL2 Q9Y4K0 1/20 0.55
SYK P43405 2/20 0.52
FBP1 P09467 1/20 0.51
KIF11 P52732 4/20 0.50
ADRB2 P07550 2/20 0.50
CYP2A6 P11509 1/20 0.46
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TLR7 Q9NYK1 1/20 0.42
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41

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
SCHEMBL722198 0.83 PDPK1 (0.77) PDPK1LOXL2ADRB2CYP2A6HDAC3
SCHEMBL679895 0.81 PDPK1 (0.57) PDPK1LOXL2KIF11ADRB2CYP2A6
SCHEMBL3069106 0.79 PDPK1 (0.55) PDPK1LOXL2CYP2A6KDM4EMEN1
SCHEMBL4589649 0.78 PDPK1 (0.63) PDPK1LOXL2SYKFBP1ADRB2
SCHEMBL19219079 0.78 PDPK1 (0.63) PDPK1LOXL2ADRB2CYP2A6KDM4E
SCHEMBL15668775 0.77 SYK (0.50) SYKFBP1KDM4EMEN1KMT2A
SCHEMBL1653986 0.77 PDPK1 (0.68) PDPK1LOXL2ADRB2CYP2A6KDM4E
SCHEMBL468075 0.77 PDPK1 (0.52) PDPK1LOXL2ADRB2CYP2A6KDM4E
SCHEMBL17801290 0.77 CYP2A6 (0.50) PDPK1LOXL2SYKADRB2CYP2A6
SCHEMBL20422053 0.77 SYK (0.52) PDPK1SYKFBP1KIF11CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110603254-B Substituted pyrazole compounds and methods of using the same for treating hyperproliferative diseases 班塔姆制药有限责任公司 2024-04-12 CN claimed
CN-110603254-A Substituted pyrazole compounds and methods of using the same for treating hyperproliferative diseases 班塔姆制药有限责任公司 2019-12-20 CN claimed
CN-110103529-A A kind of sphygmomanometer environment-friendly composite material and preparation method thereof 王才阳 2019-08-09 CN claimed
CN-108383858-B Derivatives of imidazothiadiazoles and imidazopyrazines for the treatment of platelet aggregation 百时美施贵宝公司 2024-09-20 CN disclosed
CN-110603254-B Substituted pyrazole compounds and methods of using the same for treating hyperproliferative diseases 班塔姆制药有限责任公司 2024-04-12 CN disclosed
CN-110049973-B 1, 4-diphenyl-1H-imidazole and 2, 4-diphenyl thiazole derivatives, and preparation method and application thereof 南方医科大学 2023-02-17 CN disclosed
EP-4101297-A1 COMPOSITIONS, FORMULATIONS AND METHODS FOR TREATING OCULAR DISEASES Aerpio Pharmaceuticals, Inc. (US) 2022-12-14 EP disclosed
US-20220211675-A1 TIE-2 ACTIVATORS TARGETING THE SCHLEMM'S CANAL EyePoint, Inc. 2022-07-07 US disclosed
US-20220117946-A1 HUMAN PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE EyePoint Pharmaceuticals, Inc. 2022-04-21 US disclosed
CN-114269341-A Tie-2 activator targeting Schlemm's canal 视点制药公司 2022-04-01 CN disclosed
US-11253502-B2 Tie-2 activators targeting the Schlemm's canal EyePoint Pharmaceuticals, Inc. (US) 2022-02-22 US disclosed
WO-2003072102-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2003-09-04 WO disclosed
WO-2003072100-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2003-09-04 WO disclosed
EP-0538310-B1 ETHYNYLBENZOTHIOPHENE PESTICIDES FMC CORP (US) 1995-09-13 EP disclosed
EP-0538310-A4 ETHYNYLBENZOTHIOPHENE PESTICIDES 1993-07-14 EP disclosed
EP-0538310-A1 ETHYNYLBENZOTHIOPHENE PESTICIDES. FMC CORP (US) 1993-04-28 EP disclosed
WO-1992000672-A1 ETHYNYLBENZOTHIOPHENE PESTICIDES FMC CORPORATION (US) 1992-01-23 WO disclosed
US-5073564-A Photoactivated insecticides FMC CORPORATION (US) 1991-12-17 US disclosed
US-4889867-A Photoactivated miticidal and insecticidal ethynyl-thiazoles FMC CORPORATION (US) 1989-12-26 US disclosed
US-4788207-A Photoactivated miticidal and insecticidal ethynylthiazoles FMC CORPORATION (US) 1988-11-29 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 (3 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-20220117946-A1 HUMAN PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE PTPRCAP, PTPRC, PPP5C PDPK1 635/4885LOXL2 1265/4885SYK 735/4885
US-20220211675-A1 TIE-2 ACTIVATORS TARGETING THE SCHLEMM'S CANAL TIE1, TEK, TGFB2 PDPK1 1101/4885LOXL2 169/4885SYK 1922/4885
US-11253502-B2 Tie-2 activators targeting the Schlemm's canal TIE1, TEK, TGFB2 PDPK1 1101/4885LOXL2 169/4885SYK 1922/4885

“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.