SCHEMBL2939113

SCHEMBL2939113

C=CCCOS(=O)(=O)C(F)(F)F

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.54
CA9 Q16790 1/20 0.54
CA1 P00915 1/20 0.39

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
SCHEMBL7315721 0.88 CA2 (0.41) CA2CA9CA1
SCHEMBL1118549 0.86 CA2 (0.39) CA2CA9CA1
SCHEMBL2678685 0.84 LPAR3 (0.42) CA2CA9CA1
SCHEMBL17728705 0.84 LPAR3 (0.42) CA2CA9CA1
SCHEMBL1118545 0.84 LPAR3 (0.42) CA2CA9CA1
SCHEMBL37730 0.82 CA2 (0.37) CA2CA9CA1
SCHEMBL30865709 0.80 CA2 (0.35) CA2CA9CA1
SCHEMBL27540621 0.80 CA2 (0.35) CA2CA9CA1
SCHEMBL31375314 0.80 CA2 (0.35) CA2CA9CA1
SCHEMBL27810105 0.80 CA2 (0.35) CA2CA9CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3655408-B1 CONFORMATIONAL RESTRICTION OF CYANINE FLUOROPHORES IN FAR-RED AND NEAR-IR RANGE US HEALTH (US) 2021-07-14 EP claimed
US-10994029-B2 Conformational restriction of cyanine fluorophores in far-red and near-IR range THE USA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2021-05-04 US claimed
US-20200179536-A1 CONFORMATIONAL RESTRICTION OF CYANINE FLUOROPHORES IN FAR-RED AND NEAR-IR RANGE THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVIC (US) 2020-06-11 US claimed
EP-3655408-A1 CONFORMATIONAL RESTRICTION OF CYANINE FLUOROPHORES IN FAR-RED AND NEAR-IR RANGE The U.S.A. As Represented By The Secretary, Department Of Health And Human Services (US) 2020-05-27 EP claimed
WO-2019040825-A1 CONFORMATIONAL RESTRICTION OF CYANINE FLUOROPHORES IN FAR-RED AND NEAR-IR RANGE THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2019-02-28 WO claimed
US-11707537-B2 Conformational restriction of cyanine fluorophores in far-red and near-IR range THE USA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-07-25 US disclosed
US-11707537-B2 Conformational restriction of cyanine fluorophores in far-red and near-IR range THE USA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-07-25 US disclosed
US-20210220490-A1 CONFORMATIONAL RESTRICTION OF CYANINE FLUOROPHORES IN FAR-RED AND NEAR-IR RANGE THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVIC (US) 2021-07-22 US disclosed
EP-3655408-B1 CONFORMATIONAL RESTRICTION OF CYANINE FLUOROPHORES IN FAR-RED AND NEAR-IR RANGE US HEALTH (US) 2021-07-14 EP disclosed
US-10994029-B2 Conformational restriction of cyanine fluorophores in far-red and near-IR range THE USA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2021-05-04 US disclosed
US-20200179536-A1 CONFORMATIONAL RESTRICTION OF CYANINE FLUOROPHORES IN FAR-RED AND NEAR-IR RANGE THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVIC (US) 2020-06-11 US disclosed
EP-3655408-A1 CONFORMATIONAL RESTRICTION OF CYANINE FLUOROPHORES IN FAR-RED AND NEAR-IR RANGE The U.S.A. As Represented By The Secretary, Department Of Health And Human Services (US) 2020-05-27 EP disclosed
EP-1019389-B1 EPOTHILONE DERIVATIVES BRISTOL MYERS SQUIBB CO (US) 2005-11-09 EP disclosed
EP-1531153-A1 Epothilone derivatives BRISTOL-MYERS SQUIBB COMPANY (US) 2005-05-18 EP disclosed
EP-1526133-A1 Epothilone derivatives BRISTOL-MYERS SQUIBB COMPANY (US) 2005-04-27 EP disclosed
EP-1493738-A1 Epothilone derivatives BRISTOL-MYERS SQUIBB COMPANY (US) 2005-01-05 EP disclosed
US-20030220295-A1 Microtubule-stabilizing agents useful in the treatment of a variety of cancers R-PHARM US OPERATING LLC 2003-11-27 US disclosed
US-6605599-B1 Antiproliferation agents; exerting microtubule stabilizing effects BRISTOL-MYERS SQUIBB COMPANY 2003-08-12 US disclosed
EP-1019389-A2 EPOTHILONE DERIVATIVES BRISTOL-MYERS SQUIBB COMPANY (US) 2000-07-19 EP disclosed
WO-1999002514-A2 EPOTHILONE DERIVATIVES BRISTOL-MYERS SQUIBB COMPANY (US) 1999-01-21 WO 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 (5 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-20030220295-A1 Microtubule-stabilizing agents useful in the treatment of a variety of cancers MAPRE1, TUBB3, MAPRE2 CA2 3063/4885CA9 3078/4885CA1 2877/4885
US-20210220490-A1 CONFORMATIONAL RESTRICTION OF CYANINE FLUOROPHORES IN FAR-RED AND NEAR-IR RANGE IK, FAR1, SPR CA2 525/4885CA9 125/4885CA1 1012/4885
US-10994029-B2 Conformational restriction of cyanine fluorophores in far-red and near-IR range IK, FAR1, SPR CA2 525/4885CA9 125/4885CA1 1012/4885
US-20200179536-A1 CONFORMATIONAL RESTRICTION OF CYANINE FLUOROPHORES IN FAR-RED AND NEAR-IR RANGE IK, FAR1, SPR CA2 525/4885CA9 125/4885CA1 1012/4885
US-11707537-B2 Conformational restriction of cyanine fluorophores in far-red and near-IR range IK, FAR1, SPR CA2 525/4885CA9 125/4885CA1 1012/4885

“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.