SCHEMBL16089554

SCHEMBL16089554

Oc1ccc(F)c(I)c1F

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA3 P07451 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
CA5B Q9Y2D0 1/20 0.39
MEP1B Q16820 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MPI P34949 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ESR1 P03372 2/20 0.32
ESR2 Q92731 2/20 0.32
HSD17B1 P14061 3/20 0.31
HSD17B2 P37059 3/20 0.31
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
DAO P14920 1/20 0.31
DDO Q99489 1/20 0.31

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
SCHEMBL7737173 0.79 CA3 (0.39) CA3CA6CA5ACA9CA14
SCHEMBL13488 0.77 CES2 (0.36) CES2CES1
SCHEMBL155976 0.75 CES2 (0.46) CA3CA6CA5ACA9CA14
SCHEMBL25346822 0.74 CA3 (0.39) CA3CA6CA5ACA9CA14
SCHEMBL29987655 0.73 PIM1 (0.41) CA3CA6CA5ACA9CA14
SCHEMBL1512796 0.73 PIM1 (0.41) CA3CA6CA5ACA9CA14
SCHEMBL22861600 0.72 KDM4E (0.40) KDM4EDAODDO
SCHEMBL8597374 0.72 CES2 (0.44) CA3CA6CA5ACA9CA14
SCHEMBL29766667 0.72 CA3 (0.42) CA3CA6CA5ACA9CA14
SCHEMBL669072 0.72 CA3 (0.42) CA3CA6CA5ACA9CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014152431-A1 STABILIZATION OF RADIOIODINATED AND ASTATINATED PHARMACEUTIALS AND IMAGING AGENTS Ground Fluor Pharmaceuticals, Inc. (US) 2014-09-25 WO disclosed
US-20140275539-A1 STABILIZATION OF RADIOIODINATED AND ASTATINATED PHARMACEUTICALS AND IMAGING AGENTS Ground Fluor Pharmaceuticals, Inc. (US) 2014-09-18 US disclosed
US-20140275539-A1 STABILIZATION OF RADIOIODINATED AND ASTATINATED PHARMACEUTICALS AND IMAGING AGENTS Ground Fluor Pharmaceuticals, Inc. (US) 2014-09-18 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-20140275539-A1 STABILIZATION OF RADIOIODINATED AND ASTATINATED PHARMACEUTICALS AND IMAGING AGENTS TTR, SSTR4, RNF114 CA3 3550/4885CA6 3968/4885CA5A 4511/4885

“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.