SCHEMBL524351

SCHEMBL524351

N#Cc1ccc(C(F)(F)F)cc1

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.86
CYP3A4 P08684 1/20 0.54
CYP3A5 P20815 1/20 0.54
PTPN5 P54829 1/20 0.50
CYP19A1 P11511 5/20 0.48
DGAT1 O75907 1/20 0.46
SOAT1 P35610 1/20 0.46
KCNH2 Q12809 1/20 0.46
ALDH1A1 P00352 3/20 0.46
CYP2A6 P11509 1/20 0.46
CA12 O43570 1/20 0.46
CA2 P00918 1/20 0.46
CA3 P07451 1/20 0.46
CA6 P23280 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
VNN1 O95497 1/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
ALOX15 P16050 1/20 0.44

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
Hydrochloric Acid SCHEMBL27812058 0.97 KIF11 (0.83) KIF11CYP3A4CYP3A5PTPN5CYP19A1
SCHEMBL3456838 0.93 KIF11 (1.00) KIF11CYP3A4CYP3A5PTPN5CYP19A1
SCHEMBL16626137 0.93 KIF11 (0.76) KIF11CYP3A4CYP3A5PTPN5CYP19A1
SCHEMBL13063632 0.93 KIF11 (1.00) KIF11CYP3A4CYP3A5PTPN5CYP19A1
SCHEMBL31739219 0.87 KIF11 (0.68) KIF11CYP3A4CYP3A5PTPN5CYP19A1
SCHEMBL458229 0.87 KIF11 (0.68) KIF11CYP3A4CYP3A5PTPN5CYP19A1
Oxalic Acid SCHEMBL27590382 0.87 KIF11 (0.68) KIF11CYP3A4CYP3A5PTPN5CA2
SCHEMBL11039193 0.87 KIF11 (0.68) KIF11CYP3A4CYP3A5PTPN5CYP19A1
SCHEMBL2119044 0.87 KIF11 (0.68) KIF11CYP3A4CYP3A5PTPN5CYP19A1
Thiophene SCHEMBL27316624 0.85 KIF11 (0.66) KIF11CYP3A4CYP3A5PTPN5CYP19A1

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 1040 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121735989-B Method for catalyzing hydroboration reaction of nitrile compound WEIFANG UNIVERSITY (CN) 2026-05-26 CN claimed
CN-120028308-A Small molecule Raman probe, bar code probe, encoding method and application thereof 北京大学 2025-05-23 CN claimed
CN-119306209-A Carbon quantum dot material and preparation method and application thereof 西北工业大学 2025-01-14 CN claimed
CN-119213579-A Electrolyte composition for lithium ion battery cells having anodes comprising a blend of silicon-carbon composite particles and graphite particles 新罗纳米技术有限公司 2024-12-27 CN claimed
CN-116574030-B Preparation method of fluvoxamine 珠海保税区丽珠合成制药有限公司 2024-11-29 CN claimed
US-20240297337-A1 LITHIUM-ION BATTERIES COMPRISING HIGH LITHIUM-DENSITY SUPPLEMENTAL CATHODE ACTIVE MATERIAL SILA NANOTECHNOLOGIES, INC. 2024-09-05 US claimed
CN-116037101-B Biochar-supported single-atom catalyst and application thereof in quinazoline compound synthesis 浙江大学衢州研究院 2024-08-23 CN claimed
CN-118084728-A Preparation method of p-trifluoromethyl benzonitrile 杭州柏榆生物科技有限公司 2024-05-28 CN claimed
EP-3315579-B1 SURFACE TREATMENT AGENT INCLUDING PERFLUORO(POLY)ETHER GROUP-CONTAINING SILANE COMPOUND DAIKIN IND LTD (JP) 2024-05-01 EP claimed
CN-117613391-A Design method of high-concentration organic electrolyte formula 中国科学院长春应用化学研究所 2024-02-27 CN claimed
US-6380436-B1 REACTING 4-TRIFLUOROMETHYLBENZONITRILE WITH GRIGNARD REAGENT SUN PHARMACEUTICAL INDUSTRIES LTD. (IN) 2002-04-30 US claimed
US-6362372-B2 HYDROGENATION OF A TRIFLUOROBENZYLNITRILE BY HYDROGEN IN AN ORGANIC SOLVENT IN THE PRESENCE OF AMMONIA AND A CATALYST COMPRISING A PLATINUM GROUP ELEMENT; EXTREMELY HIGH YIELDS CENTRAL GLASS COMPANY, LIMITED (JP) 2002-03-26 US claimed
US-20020007086-A1 Process for producing trifluoromethylbenzylamines CENTRAL GLASS COMPANY, LIMITED (JP) 2002-01-17 US claimed
US-6242623-B1 POLYMERIZATION CATALYSTS OF COORDINATION CATALYSTS SYMYX TECHNOLOGIES, INC. 2001-06-05 US claimed
WO-1999058485-A1 A PROCESS FOR THE SYNTHESIS OF ALKOXYALKYL (TRIFLUOROMETHYLPHENYL) METHANONES SUN PHARMACEUTICALS INDUSTRIES LTD. (IN) 1999-11-18 WO claimed
US-5124487-A Catalytic reduction of nitriles to aldehydes OCCIDENTAL CHEMICAL CORPORATION (US) 1992-06-23 US claimed
EP-0384392-A1 Cyanation of haloaromatics utilizing catalysts generated in situ starting with NiCl2 or NiCl2 6H2O OCCIDENTAL CHEMICAL CORPORATION (US) 1990-08-29 EP claimed
US-4822903-A Fluorinated silica catalyst and preparation of aromatic/aliphatic nitriles in the presence thereof RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1989-04-18 US claimed
US-4438042-A FROM AMIDES, FLUORINATE SILCEOUS CATALYSTS RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1984-03-20 US claimed
US-4436669-A CYANATION, DECARBONYLATION, ACID CATALYSTS RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1984-03-13 US claimed

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-20020007086-A1 Process for producing trifluoromethylbenzylamines IDH1, INMT, TH KIF11 2157/4885CYP3A4 172/4885CYP3A5 460/4885

“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.