SCHEMBL809118

SCHEMBL809118

N#Cc1c(F)c(F)cc(F)c1F

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 3/20 0.50
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
CA4 P22748 2/20 0.33
CA12 O43570 1/20 0.33
CA7 P43166 1/20 0.33
CA13 Q8N1Q1 1/20 0.33
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
DHODH Q02127 1/20 0.31
KHK P50053 1/20 0.30
STAT3 P40763 1/20 0.30

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
Acetonitrile SCHEMBL23071362 0.92 TRPV4 (0.44) TRPV4CA1CA2CA4CA12
Cyclopropane SCHEMBL28838233 0.92 TRPV4 (0.44) TRPV4CA1CA2CA4CA12
SCHEMBL7868318 0.89 TRPV4 (0.52) TRPV4CA1CA2CA4CA12
SCHEMBL5338291 0.85 TRPV4 (0.45) TRPV4ESR1ESR2CES2CES1
SCHEMBL7649737 0.85 TRPV4 (0.45) TRPV4ESR1ESR2CES2CES1
SCHEMBL29728453 0.83 TRPV4 (0.52) TRPV4CA1CA2CA4CA12
SCHEMBL809217 0.83 TRPV4 (0.52) TRPV4CA1CA2CA4CA12
SCHEMBL13082286 0.83 TRPV4 (0.41) TRPV4DHODH
SCHEMBL3209942 0.83 TRPV4 (0.46) TRPV4CA1CA2CA12CA7
SCHEMBL289995 0.83 TRPV4 (0.41) TRPV4DHODHSTAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118598860-A Thermal activation delayed fluorescent material capable of being processed by solution method and preparation method and application thereof 东南大学 2024-09-06 CN claimed
CN-114751807-B Preparation process of 2,3,5, 6-tetrafluorobenzyl alcohol 忠同科技(大连)有限公司 2023-08-22 CN claimed
CN-116162236-A Preparation method of branched polyaryletherketone resin, branched polyaryletherketone resin and application of branched polyaryletherketone resin in gas separation membrane 中国科学院大连化学物理研究所 2023-05-26 CN claimed
CN-111533679-B Thermal crosslinking dendritic thermal activation delayed fluorescent material and synthesis and application thereof 山西穿越光电科技有限责任公司 2022-12-13 CN claimed
CN-114957276-A Active ester curing agent and preparation method thereof, epoxy resin composition, composite film and application thereof 深圳先进电子材料国际创新研究院 2022-08-30 CN claimed
CN-113336694-B Thermally activated sensitized fluorescent dendritic material capable of being processed in solution and preparation method thereof 东南大学 2022-08-26 CN claimed
CN-114751807-A Novel efficient preparation process of 2,3,5, 6-tetrafluorobenzyl alcohol 忠同科技(大连)有限公司 2022-07-15 CN claimed
CN-111187154-B Synthetic method of sitagliptin intermediate 2,4, 5-trifluoro phenylacetic acid 浙江九洲药业股份有限公司 2022-05-10 CN claimed
CN-113336694-A Thermally activated sensitized fluorescent dendritic material capable of being processed in solution and preparation method thereof 东南大学 2021-09-03 CN claimed
CN-111533679-A Peripheral thermal-crosslinking branch group, thermal-crosslinking dendritic thermal-activation delayed fluorescent material and synthesis method and application thereof 盐城工学院 2020-08-14 CN claimed
CN-111187154-A Synthetic method of sitagliptin intermediate 2,4, 5-trifluoro phenylacetic acid 浙江九洲药业股份有限公司 2020-05-22 CN claimed
CN-104478669-A Asymmetric terphenyl liquid crystal compound UNIV SHIHEZI 2015-04-01 CN claimed
US-8952083-B2 Fluorocopolymer composition and its production process ASAHI GLASS COMPANY, LIMITED (JP) 2015-02-10 US claimed
CN-102439746-A Interconnector for organic electronic devices GLOBAL OLED TECHNOLOGY LLC 2012-05-02 CN claimed
EP-1534665-B1 PRODUCTION PROCESS OF FLUORINATED BENZONITRILE SHOWA DENKO KK (JP) 2010-04-21 EP claimed
US-7569718-B2 Production process of fluorinated benzonitrile SHOWA DENKO K.K. (JP) 2009-08-04 US claimed
US-20050131245-A1 Production process of fluorinated benzonitrile SHOWA DENKO K. K. (JP) 2005-06-16 US claimed
EP-1534665-A1 PRODUCTION PROCESS OF FLUORINATED BENZONITRILE Showa Denko K.K. (JP) 2005-06-01 EP claimed
WO-2004009535-A1 PRODUCTION PROCESS OF FLUORINATED BENZONITRILE SHOWA DENKO K.K. (JP) 2004-01-29 WO claimed
US-6020517-A Process for production of benzonitrile and benzyl alcohol SHOWA DENKO K.K. (JP) 2000-02-01 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-20050131245-A1 Production process of fluorinated benzonitrile DBF4, DDT, CA4 TRPV4 264/4885CA1 409/4885CA2 147/4885

“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.