SCHEMBL4323924

SCHEMBL4323924

O=[N+]([O-])c1cccc(P(=O)(c2ccc(F)cc2)c2ccc(F)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.50
▸ LMNA P02545 2/20 0.50
▸ GAA P10253 3/20 0.46
▸ MAPT P10636 2/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.44
▸ ALDH1A1 P00352 4/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ ACHE P22303 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ HTT P42858 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HSP90AA1 P07900 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ MAPK1 P28482 1/20 0.41
▸ HSPB1 P04792 1/20 0.41

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
SCHEMBL30764114 0.88 TSHR (0.64) TSHRLMNAGAANPSR1ALDH1A1
SCHEMBL8408187 0.88 TSHR (0.64) TSHRLMNAGAANPSR1ALDH1A1
SCHEMBL30764106 0.86 TSHR (0.57) TSHRLMNAMAPTNPSR1ALDH1A1
SCHEMBL29176796 0.86 TSHR (0.57) TSHRLMNAMAPTNPSR1ALDH1A1
SCHEMBL16774768 0.86 TSHR (0.57) TSHRLMNAMAPTNPSR1ALDH1A1
SCHEMBL7620892 0.83 TSHR (0.46) TSHRLMNAMAPTNPSR1ALDH1A1
SCHEMBL11991132 0.80 MEN1 (0.41) LMNAMAPTALDH1A1KMT2AMEN1
SCHEMBL7182963 0.78 NPSR1 (0.40) TSHRLMNAMAPTNPSR1ALDH1A1
SCHEMBL7182952 0.78 TSHR (0.40) TSHRLMNANPSR1ALDH1A1TDP1
SCHEMBL11418761 0.78 TSHR (0.59) TSHRLMNAGAANPSR1ALDH1A1

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
US-7635744-B2 Trifluorovinyloxy monomers and polymers GENERAL ELECTRIC COMPANY (US) 2009-12-22 — — US disclosed
US-20070238856-A1 Trifluorovinyloxy monomers and polymers GENERAL ELECTRIC COMPANY 2007-10-11 — — US disclosed
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