SCHEMBL3878047

SCHEMBL3878047

CCCCOc1c(C)cc([S+]2CCCC2)cc1C.O=S(=O)([O-])c1ccc(F)cc1F

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.32
MAPT P10636 2/20 0.32
TP53 P04637 1/20 0.32
KAT6A Q92794 1/20 0.32
KCNH2 Q12809 1/20 0.31
ALDH1A1 P00352 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
PTGS1 P23219 1/20 0.30
PTGS2 P35354 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30
RECQL P46063 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
PDIA6 Q15084 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
SCHEMBL3874688 0.88 FFAR4 (0.32) ALDH1A1FFAR4TSHRMAPK1RECQL
SCHEMBL3876688 0.82 THRA (0.33) TSHRMAPK1RECQLL3MBTL1
SCHEMBL3873395 0.80 PTGS1 (0.39) MAPTKCNH2ALDH1A1PTGS1PTGS2
Trifluoromethanesulfonic Acid SCHEMBL3876850 0.80 KCNH2 (0.34) KCNH2FFAR4PTGS1PTGS2TSHR
SCHEMBL3871384 0.80 ALDH1A1 (0.40) TP53KAT6AALDH1A1TSHRMAPK1
SCHEMBL3872275 0.78 THRA (0.38) MAPTALDH1A1TSHR
SCHEMBL3872556 0.77 FABP4 (0.40) FAAHALDH1A1TSHRL3MBTL1
SCHEMBL3871480 0.75 TSHR (0.31) PTGS1PTGS2TSHRMAPK1RECQL
SCHEMBL3873622 0.74 TSHR (0.31) PTGS1PTGS2TSHRMAPK1RECQL
SCHEMBL3878050 0.71 FAAH (0.32) FAAHMAPTTP53KAT6AKCNH2

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 6 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
US-20030219680-A1 Photoresists useful for microfabrication utilizing deep ultraviolet rays such as an excimer laser, x-rays such as synchrotron radiation, and electron beams JSR CORPORATION (JP) 2003-11-27 US disclosed