SCHEMBL18181713

SCHEMBL18181713

Fc1cc(F)c(F)c(-c2ccc(-c3c(F)c(F)cc(F)c3F)cc2)c1F

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
CA4 P22748 2/20 0.35
CA12 O43570 1/20 0.35
CA7 P43166 1/20 0.35
CA13 Q8N1Q1 1/20 0.35
PTGS2 P35354 9/20 0.33
PTGS1 P23219 4/20 0.33
TTR P02766 1/20 0.33
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32

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
SCHEMBL29103268 0.92 PTGS2 (0.42) CA1CA2CA7PTGS2PTGS1
SCHEMBL13241353 0.87 ESR1 (0.46) ESR1ESR2
SCHEMBL4138493 0.87 PTGS2 (0.46) PTGS2PTGS1
SCHEMBL2139894 0.86 LMNA (0.42) TTR
SCHEMBL28248236 0.83 KIF11 (0.46)
SCHEMBL31711777 0.82 ESR1 (0.34) CA1CA2CA4CA12CA7
SCHEMBL29038713 0.82 KIF11 (0.49) PTGS1
SCHEMBL31711762 0.80 HSD17B1 (0.33) CA1CA2CA4CA12CA7
SCHEMBL1995798 0.79 CA1 (0.41) CA1CA2CA4CA12CA7
SCHEMBL28112435 0.77 CYP1A2 (0.46) CA1CA2ESR1ESR2

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-4638547-A1 AROMATIC POLYMER, PROCESS FOR PRODUCING A POLYMER, MEMBRANE AND USE OF A MEMBRANE Forschungszentrum Jülich GmbH (DE) 2025-10-29 EP disclosed
US-20160315348-A1 POLYMER NETWORK SINGLE ION CONDUCTORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-10-27 US disclosed