SCHEMBL187613

SCHEMBL187613

NNc1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
CA12 O43570 1/20 0.55
CA7 P43166 1/20 0.55
CA13 Q8N1Q1 1/20 0.55
ALDH1A1 P00352 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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 SCHEMBL4349881 0.96 CA1 (0.52) CA1CA2CA12CA7CA13
SCHEMBL4907726 0.87 CA1 (0.46) CA1CA2CA12CA7CA13
SCHEMBL8059165 0.86 CA1 (0.50) CA1CA2CA12CA7CA13
SCHEMBL18593300 0.83 CA1 (0.43) CA1CA2CA12CA7CA13
SCHEMBL5513979 0.81 CA12 (0.46) CA1CA2CA12CA7CA13
SCHEMBL10616331 0.81 CA12 (0.46) CA1CA2CA12CA7CA13
SCHEMBL4908210 0.81 CA1 (0.41) CA1CA2CA12CA7CA13
SCHEMBL22023634 0.81 CA1 (0.41) CA1CA2CA12CA7CA13
SCHEMBL4343529 0.81 CA12 (0.46) CA1CA2CA12CA7CA13
SCHEMBL18593304 0.78 CA1 (0.39) CA1CA2CA12CA7CA13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118507836-B Electrolyte for secondary lithium metal battery 深圳欣界能源科技有限公司 2024-09-17 CN claimed
CN-118507836-A Electrolyte for secondary lithium metal battery 深圳欣界能源科技有限公司 2024-08-16 CN claimed
CN-116559321-A Method for detecting free formaldehyde in cosmetics 上海国齐检测技术有限公司 2023-08-08 CN claimed
CN-116041213-A Colorimetric sensor capable of identifying fluoride ions singly and selectively based on double-pentafluorophenyl hydrazone functionalization and synthesis and application thereof 西北民族大学 2023-05-02 CN claimed
WO-2022122846-A1 ETHODS OF DETECTING ALDEHYDES IN SAMPLES LONZA LTD (CH) 2022-06-16 WO claimed
WO-2022083759-A1 ANTICOAGULATION AND ANTICALCIFICATION ARTIFICIAL HEART VALVE MATERIAL, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 吉林启明皓月生物科技有限公司 2022-04-28 WO claimed
CN-112263715-A Anticoagulation and calcification-resistant artificial heart valve material and preparation method and application thereof 四川大学 2021-01-26 CN claimed
CN-112098534-A Method for detecting metabolite and kit thereof 必睿思(杭州)科技有限公司 2020-12-18 CN claimed
CN-111398463-A Method for detecting content of aldehydes and ketones in exhaled air 必睿思(杭州)科技有限公司 2020-07-10 CN claimed
CN-110596286-A Method for rapidly detecting carbonyl-containing product in atmospheric reaction and application thereof 广东工业大学 2019-12-20 CN claimed
US-20160226072-A1 Fluorinated Coatings for High Performance Electrodes MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2016-08-04 US claimed
US-20140147926-A1 METHOD OF ANALYZING ALDEHYDE COMPOUND IN METAL PLATING SOLUTION SAMSUNG ELECTRO-MECHANICS CO., LTD. (KR) 2014-05-29 US claimed
US-20110086429-A1 METHODS AND DEVICES FOR DETECTING OZONE AND CARBONYL-CONTAINING COMPOUNDS SIGMA-ALDRICH CO. (US) 2011-04-14 US claimed
EP-2232254-A1 METHODS AND DEVICES FOR SIMULTANEOUSLY DETECTING OZONE AND CARBONYL- CONTAINING COMPOUNDS Sigma-Aldrich Co. (US) 2010-09-29 EP claimed
WO-2009086304-A1 METHODS AND DEVICES FOR SIMULTANEOUSLY DETECTING OZONE AND CARBONYL- CONTAINING COMPOUNDS SIGMA-ALDRICH CO. (US) 2009-07-09 WO claimed
US-7090829-B2 Antitumor agnets; anticancer agents; antidiabetic agents CARBOMER, INC. (US) 2006-08-15 US claimed
WO-2003086474-A2 FLUORINATED OR PARAMAGNETIC ALGINATE POLYMER, ANNEXIN PARAMAGNETIC CONJUGATE, AND THEIR USE AS CONTRASTING AGENT IN MRI CARBOMER, INC (US) 2003-10-23 WO claimed
US-20030198599-A1 Novel imaging probes CARBOMER, INC. 2003-10-23 US claimed
US-5897940-A Ink jet transparencies XEROX CORPORATION (US) 1999-04-27 US claimed
US-4351948-A Imidazole hydrazone derivatives G.D. SEARLE & CO. (US) 1982-09-28 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-20030198599-A1 Novel imaging probes MPI, MIA3, PITPNB CA1 986/4885CA2 2004/4885CA12 340/4885

“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.