SCHEMBL24339409

SCHEMBL24339409

O=C(Oc1c(F)c(F)cc(F)c1F)c1cnc(SF)cn1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.34
▸ GABRA1 P14867 1/20 0.33
▸ GABRG2 P18507 1/20 0.33
▸ GABRB3 P28472 1/20 0.33
▸ GABRA5 P31644 1/20 0.33
▸ GABRA3 P34903 1/20 0.33
▸ GABRA2 P47869 1/20 0.33
▸ GABRA4 P48169 1/20 0.33
▸ GABRA6 Q16445 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.31
▸ ASPH Q12797 1/20 0.31
▸ KDM8 Q8N371 1/20 0.31
▸ MAPT P10636 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ CA2 P00918 1/20 0.30
▸ CA4 P22748 1/20 0.30

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
SCHEMBL19360825 0.82 POLB (0.37) POLBGABRA1GABRG2GABRB3GABRA5
SCHEMBL19360023 0.82 POLB (0.37) POLBGABRA1GABRG2GABRB3GABRA5
SCHEMBL29525770 0.82 POLB (0.37) POLBGABRA1GABRG2GABRB3GABRA5
SCHEMBL17573509 0.81 KMT2A (0.50) POLBMEN1KMT2ATDP1ALDH1A1
SCHEMBL19360804 0.79 POLB (0.36) POLBGABRA1GABRG2GABRB3GABRA5
SCHEMBL23812490 0.79 ALDH1A1 (0.37) MEN1KMT2AKDM4EALDH1A1HTT
SCHEMBL5889663 0.76 TDP1 (0.41) POLBMEN1KMT2ATDP1KDM4E
SCHEMBL19360004 0.74 POLB (0.40) POLBGABRA1GABRG2GABRB3GABRA5
SCHEMBL19816909 0.74 MAPK1 (0.53) POLBGABRA1GABRG2GABRB3GABRA5
SCHEMBL19360017 0.73 POLB (0.37) POLBGABRA1GABRG2GABRB3GABRA5

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 1 patent. 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
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