SCHEMBL3549311

SCHEMBL3549311

O=C(Nc1ccc(O)cc1)C(F)(F)F

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 2/20 0.59
▸ CA1 P00915 2/20 0.59
▸ CA2 P00918 2/20 0.59
▸ CA9 Q16790 2/20 0.59
▸ MAPT P10636 4/20 0.56
▸ MEN1 O00255 2/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ ALDH1A1 P00352 2/20 0.54
▸ PEPD P12955 1/20 0.54
▸ BRD4 O60885 1/20 0.54
▸ NR1I2 O75469 1/20 0.54
▸ MB P02144 1/20 0.54
▸ CYP1A1 P04798 1/20 0.54
▸ CA3 P07451 1/20 0.54
▸ CYP3A4 P08684 1/20 0.54
▸ RARG P13631 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ ALOX5AP P20292 1/20 0.54
▸ CA4 P22748 1/20 0.54
▸ CA7 P43166 1/20 0.54

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
SCHEMBL3765919 0.83 CA12 (0.59) CA12CA1CA2CA9MAPT
SCHEMBL5549558 0.83 CA12 (0.59) CA12CA1CA2CA9MAPT
SCHEMBL5550330 0.81 HDAC1 (0.67) CA12CA1CA2CA9MAPT
SCHEMBL1310823 0.81 HDAC1 (0.67) CA12CA1CA2CA9MAPT
SCHEMBL5546929 0.81 HDAC1 (0.67) CA12CA1CA2CA9MAPT
SCHEMBL3454327 0.81 CA12 (0.62) CA12CA1CA2CA9MAPT
SCHEMBL13002990 0.81 MAPT (0.59) CA12CA1CA2CA9MAPT
SCHEMBL6521536 0.81 CA12 (0.58) CA12CA1CA2CA9MAPT
SCHEMBL20870704 0.81 EPHX2 (0.70) CA12CA1CA2CA9MAPT
SCHEMBL490629 0.81 CA12 (0.58) CA12CA1CA2CA9MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240027902-A1 CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-01-25 — — US disclosed
US-20240027902-A1 CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-01-25 — — US disclosed
US-20230359119-A1 RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-11-09 — — US disclosed
US-20230305393-A1 RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-09-28 — — US disclosed
US-20230305394-A1 RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-09-28 — — US disclosed
US-20230305394-A1 RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-09-28 — — US disclosed
US-20230305393-A1 RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-09-28 — — US disclosed
US-20230192733-A1 SUBSTITUTED PHENYL ET458HYNYL PYRIDINE CARBOXAMIDES AS POTENT INHIBITORS OF SARS VIRUS SOUTHERN RESEARCH INSTITUTE 2023-06-22 — — US disclosed
CN-116217911-A Wear-resistant polycarbonate 万华化学集团股份有限公司 2023-06-06 — — CN disclosed
CN-111635527-A Benzimidazole polymer cross-linking agent, and preparation method and application thereof 佛山科学技术学院 2020-09-08 — — CN disclosed
WO-2005022116-A9 ANTIOXODANT SENSOR, METHODS AND COMPOSITIONS MANNATECH INC (US) 2005-11-10 — — WO disclosed
US-20050087452-A1 Antioxidant sensor, methods and compositions MANNATECH, INC. (US) 2005-04-28 — — US disclosed
WO-2005022116-A2 ANTIOXODANT SENSOR, METHODS AND COMPOSITIONS MANNATECH, INC. (US) 2005-03-10 — — WO disclosed
WO-2002074233-A2 SYSTEM AND METHOD FOR CREATING A SERIES OF THREE DIMENSIONAL GLYCAN STRUCTURES DATABASES AND THEIR APPLICATIONS GLYCOMINDS LTD. (IL) 2002-09-26 — — WO disclosed
EP-0260939-B1 MOLECULES WITH ANTIBODY COMBINING SITES THAT EXHIBIT CATALYTIC PROPERTIES SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1993-04-28 — — EP disclosed
US-5126258-A Hydrolysis of polypeptides at predetermined site SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1992-06-30 — — US disclosed
US-5030717-A Binding site which bind to reactant ligand, stabilization SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1991-07-09 — — US disclosed
US-4835180-A N-(ω-cyanoalkyl)aminophenols and use as inhibitors of lipoxygenase activity STERLING DRUG INC. (US) 1989-05-30 — — US disclosed
EP-0262618-A2 N-(omega)-cyanoalkyl)aminophenols, and their preparation STERLING DRUG INC. (US) 1988-04-06 — — EP disclosed
EP-0260939-A2 Molecules with antibody combining sites that exhibit catalytic properties SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1988-03-23 — — EP 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 (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-20230192733-A1 SUBSTITUTED PHENYL ET458HYNYL PYRIDINE CARBOXAMIDES AS POTENT INHIBITORS OF SARS VIRUS SARS1, ACE2, ACE CA12 4030/4885CA1 4637/4885CA2 2685/4885

“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.

Send feedback