SCHEMBL3870243

SCHEMBL3870243

O=S(=O)(O)C(F)(F)c1cc(F)ccc1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.46
CES2 O00748 3/20 0.39
CES1 P23141 3/20 0.39
CA9 Q16790 2/20 0.39
CA3 P07451 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA14 Q9ULX7 1/20 0.39
CA5B Q9Y2D0 1/20 0.39
PSEN1 P49768 3/20 0.33
PSEN2 P49810 3/20 0.33
APH1B Q8WW43 3/20 0.33
NCSTN Q92542 3/20 0.33
APH1A Q96BI3 3/20 0.33
PSENEN Q9NZ42 3/20 0.33
SLC22A12 Q96S37 1/20 0.33
PKM P14618 2/20 0.33
KCNN4 O15554 1/20 0.33
IDO1 P14902 1/20 0.33
CA12 O43570 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
SCHEMBL3870829 0.85 PTPN1 (0.46) PTPN1CES2CES1CA9CA3
SCHEMBL15755239 0.82 CES2 (0.41) PTPN1CES2CES1CA9CA3
SCHEMBL3870950 0.81 PTPN1 (0.37) PTPN1CES2CES1CA9CA3
SCHEMBL10675609 0.76 PTPN1 (0.43) PTPN1CES2CES1CA9CA5A
SCHEMBL2952551 0.74 CES2 (0.38) PTPN1CES2CES1CA9CA12
SCHEMBL7265211 0.72 IDO1 (0.48) CES2CES1CA9CA3CA6
SCHEMBL29775945 0.72 IDO1 (0.48) CES2CES1CA9CA3CA6
SCHEMBL29009876 0.72 AR (0.43) CES2CES1CA9CA3CA6
SCHEMBL11589919 0.71 PTPN1 (0.61) PTPN1CA9CA5AKCNN4CA1
SCHEMBL3883689 0.71 PTPN1 (0.51) PTPN1CES2CES1CA9CA5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7638261-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2009-12-29 US disclosed
US-20090148790-A1 RADIATION-SENSITIVE RESIN COMPOSITION JSR CORPORATION (JP) 2009-06-11 US disclosed
US-7521169-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2009-04-21 US disclosed
US-20060234153-A1 Radiation-sensitive resin composition JSR CORPORATION (JP) 2006-10-19 US disclosed
EP-1557718-A1 RADIATION-SENSITIVE RESIN COMPOSITION JSR Corporation (JP) 2005-07-27 EP disclosed