SCHEMBL54018

SCHEMBL54018

Fc1ccc(C([SiH2]Cn2cncn2)c2ccc(F)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 14/20 0.59
KMT2A Q03164 1/20 0.43
LMNA P02545 1/20 0.40
HSP90AA1 P07900 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
CYP2C19 P33261 1/20 0.40
ADRA1A P35348 1/20 0.40
CYP51A1 Q16850 1/20 0.40
MAPK1 P28482 1/20 0.38
FAAH O00519 1/20 0.37
MGLL Q99685 1/20 0.37

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
SCHEMBL9676996 0.88 CYP19A1 (0.51) CYP19A1KMT2ALMNAHSP90AA1CYP3A4
Flusilazole SCHEMBL3007591 0.88 CYP19A1 (0.48) CYP19A1KMT2ALMNAHSP90AA1CYP3A4
SCHEMBL28777016 0.88 CYP19A1 (0.48) CYP19A1KMT2ALMNAHSP90AA1CYP3A4
SCHEMBL9677119 0.88 CYP19A1 (0.51) CYP19A1KMT2ALMNAHSP90AA1CYP3A4
SCHEMBL10533119 0.86 CYP19A1 (0.46) CYP19A1KMT2ALMNAHSP90AA1CYP3A4
SCHEMBL9676982 0.86 CYP19A1 (0.49) CYP19A1KMT2ALMNAHSP90AA1CYP3A4
SCHEMBL10938917 0.84 CYP19A1 (0.50) CYP19A1KMT2ALMNACYP3A4
SCHEMBL9678004 0.83 CYP19A1 (0.46) CYP19A1KMT2ALMNAHSP90AA1CYP3A4
SCHEMBL10947079 0.81 MAPT (0.49) CYP19A1KMT2ALMNAHSP90AA1
SCHEMBL11032427 0.80 CYP19A1 (0.51) CYP19A1KMT2ALMNAHSP90AA1CYP3A4

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 1270 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104904730-B Sterilization composition containing ZJ5337 and triazole bactericide 浙江省化工研究院有限公司 2017-05-10 CN claimed
CN-106605656-A Synergistic bactericidal composition containing SYP-14288 and triazole 陕西韦尔奇作物保护有限公司 2017-05-03 CN claimed
CN-106588894-A Furan-containing pyridine bipyrazole formamide derivatives, and preparation method and application thereof 河北农业大学 2017-04-26 CN claimed
CN-104957145-B Bactericidal composition and its application 四川利尔作物科学有限公司 2017-04-05 CN claimed
CN-106550820-A A kind of scab of cucumber prevents and treats new method 韩浩良 2017-04-05 CN claimed
CN-106538308-A A kind of method of preventing and treating tribute Citrus chachiensis Hort. tree scab 钟山县绿森农业开发有限公司 2017-03-29 CN claimed
CN-106535633-A Compositions containing lipo-chitooligosaccharide and microorganism for enhancing plant growth 诺维信生物农业公司 2017-03-22 CN claimed
CN-106535637-A Molecules having certain pesticidal utilities, and intermediates, compositions, and processes related thereto 美国陶氏益农公司 2017-03-22 CN claimed
CN-104010505-B Pesticidal compositions and methods related thereto 陶氏益农公司 2017-03-15 CN claimed
CN-106488703-A Synergistic fungicidal mixtures for fungal control in cereals 美国陶氏益农公司 2017-03-08 CN claimed
EP-0548025-A1 Microbicide CIBA-GEIGY AG (CH) 1993-06-23 EP claimed
EP-0287346-B1 FUNGICIDE COMPOSITIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-06-24 EP claimed
EP-0358663-B1 FUNGICIDE COMPOSITIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-06-24 EP claimed
US-4987142-A FORMULATIONS HAVING REDUCED EYE IRRITATION E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-01-22 US claimed
EP-0358663-A1 FUNGICIDE COMPOSITIONS. DU PONT (US) 1990-03-21 EP claimed
WO-1988007814-A1 FUNGICIDE COMPOSITIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-10-20 WO claimed
EP-0287346-A1 Fungicide compositions E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-10-19 EP claimed
EP-0068813-B1 FUNGICIDAL 1,2,4-TRIAZOLE AND IMIDAZOLE DERIVATIVES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-09-25 EP claimed
US-4510136-A A 1-SILYLMETHYL DERIVATIVE; AGRICULTURE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-04-09 US claimed
EP-0068813-A2 Fungicidal 1,2,4-triazole and imidazole derivatives E.I. DU PONT DE NEMOURS AND COMPANY (US) 1983-01-05 EP claimed