SCHEMBL2886986

SCHEMBL2886986

C=CC(=O)OC(C)OC(=O)c1ccc(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)O)cc1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
STS P08842 3/20 0.33
CXCR2 P25025 2/20 0.32
CXCR1 P25024 1/20 0.32
RAB9A P51151 1/20 0.32
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA7 P43166 1/20 0.30
CA9 Q16790 1/20 0.30
CA14 Q9ULX7 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
SCHEMBL10233233 0.85 ELANE (0.34) STSCXCR2CXCR1RAB9ACA12
SCHEMBL2883305 0.81 NPC1 (0.34) RAB9ACA12CA1CA2CA7
SCHEMBL10204866 0.81 STS (0.34) STSCXCR2CXCR1RAB9ACA12
SCHEMBL9966126 0.80 STS (0.31) STSCXCR2CXCR1RAB9A
SCHEMBL2742217 0.80 STS (0.41) STSRAB9ACA12CA1CA2
SCHEMBL13136802 0.79 STS (0.38) STSCXCR2CXCR1RAB9ACA12
SCHEMBL9966159 0.78 TAS1R3 (0.33) CA12CA1CA2CA7CA9
SCHEMBL9966140 0.77 STS (0.55) STSRAB9ACA12CA1CA2
SCHEMBL25470385 0.76 STS (0.39) STSCXCR2CXCR1RAB9A
SCHEMBL12039864 0.74 STS (0.34) STSCXCR2

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-20120034559-A1 ACTINIC-RAY- OR RADIATION-SENSITIVE RESIN COMPOSITION, RESIST FILM THEREFROM AND METHOD OF FORMING PATTERN THEREWITH FUJIFILM CORPORATION (JP) 2012-02-09 US disclosed
US-20120003583-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, AND RESIST FILM AND PATTERN FORMING METHOD USING THE COMPOSITION FUJIFILM CORPORATION (JP) 2012-01-05 US disclosed