SCHEMBL19360855

SCHEMBL19360855

O=C(Oc1c(F)c(F)cc(F)c1F)c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.43
CA2 P00918 4/20 0.43
CA4 P22748 2/20 0.43
MAPT P10636 3/20 0.39
CES2 O00748 2/20 0.37
CES1 P23141 2/20 0.37
KMT2A Q03164 2/20 0.36
GAA P10253 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
ESR1 P03372 1/20 0.33
TTR P02766 1/20 0.33
SLC2A1 P11166 1/20 0.33
SLC2A4 P14672 1/20 0.33
ALPL P05186 1/20 0.33

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
SCHEMBL19360020 1.00 CA1 (0.43) CA1CA2CA4MAPTCES2
SCHEMBL19360821 0.90 CA1 (0.39) CA1CA2CA4MAPTCES2
SCHEMBL19360801 0.89 CA1 (0.38) CA1CA2CA4MAPTCES2
SCHEMBL19360006 0.89 KMT2A (0.36) CA1CA2CA4MAPTCES2
SCHEMBL24339045 0.86 CA1 (0.36) CA1CA2CA4MAPTCES2
SCHEMBL16322420 0.84 MAPK1 (0.38) CA1CA2MAPTCES2CES1
SCHEMBL17573463 0.83 CA1 (0.38) CA1CA2CA4MAPTKMT2A
SCHEMBL14563139 0.81 CES2 (0.43) CA1CA2CA4MAPTCES2
SCHEMBL19360015 0.81 CA1 (0.33) CA1CA2CA4KMT2ATTR
SCHEMBL2835266 0.79 KMT2A (0.39) CA1CA2MAPTKMT2AGAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3183236-B1 METHOD FOR THE PRODUCTION OF 18F-LABELED ACTIVE ESTERS AND THEIR APPLICATION EXEMPLIFIED BY THE PREPARATION OF A PSMA-SPECIFIC PET-TRACER MAX PLANCK GESELLSCHAFT ZUR FOERDERUNG DER WSS (DE) 2022-04-20 EP disclosed
US-20170267717-A1 Novel method for the production of 18F-labeled active esters and their application exemplified by the preparation of a PSMA-specific PET-tracer MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E.V. (DE) 2017-09-21 US 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-20170267717-A1 Novel method for the production of 18F-labeled active esters and their application exemplified by the preparation of a PSMA-specific PET-tracer FGB, F13B, FAP CA1 1206/4885CA2 1558/4885CA4 726/4885

“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.