SCHEMBL3766321

SCHEMBL3766321

C[S+](C)c1ccc(O)c2ccc(O)cc12.O=S(=O)([O-])c1cccnc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.38
SNCA P37840 1/20 0.34
PTGS1 P23219 1/20 0.34
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
CYP3A4 P08684 3/20 0.33
CYP17A1 P05093 2/20 0.33
CYP11B1 P15538 2/20 0.33
CYP11B2 P19099 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
HSD17B1 P14061 1/20 0.33
CYP2B6 P20813 1/20 0.33
CYP2C19 P33261 1/20 0.33
HSD17B2 P37059 1/20 0.33
ERN1 O75460 1/20 0.33
ABCC9 O60706 1/20 0.32
ABCC8 Q09428 1/20 0.32
KCNJ11 Q14654 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
SCHEMBL3759525 0.81 KMT2A (0.39) PTGS1CYP1A2CYP2C9HSD17B1HSD17B2
Hydrochloric Acid SCHEMBL31497693 0.77 ALDH1A1 (0.39) NFE2L2CYP2C9PTGS2CA12CA1
Hydrochloric Acid SCHEMBL31497694 0.77 ALDH1A1 (0.39) NFE2L2CYP2C9PTGS2CA12CA1
SCHEMBL794898 0.75 ALDH1A1 (0.41) NFE2L2CYP2C9PTGS2CA12CA1
SCHEMBL29420741 0.75 ALDH1A1 (0.41) NFE2L2CYP2C9PTGS2CA12CA1
Trifluoromethanesulfonic Acid SCHEMBL29353026 0.75 PTGS1 (0.37) PTGS1NFE2L2CYP2C9HSD17B1HSD17B2
Trifluoromethanesulfonic Acid SCHEMBL3287537 0.75 PTGS1 (0.37) PTGS1NFE2L2CYP2C9HSD17B1HSD17B2
Trifluoromethanesulfonic Acid SCHEMBL3287542 0.71 HSD17B10 (0.34) PTGS1NFE2L2CYP3A4CYP2C9HSD17B1
SCHEMBL19469378 0.71 ESR1 (0.33) PTGS1NFE2L2CYP2C9
Trifluoromethanesulfonic Acid SCHEMBL5827351 0.70 PTGS1 (0.37) PTGS1NFE2L2CYP2C9HSD17B1HSD17B2

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-7842441-B2 Norbornene polymer for photoresist and photoresist composition comprising the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2010-11-30 US disclosed
US-20090075207-A1 NORBORNENE POLYMER FOR PHOTORESIST AND PHOTORESIST COMPOSITION COMPRISING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2009-03-19 US disclosed
US-20080145783-A1 Photosensitive Resin Composition and Organic Insulating Film Produced Using the Same CHEIL INDUSTRIES INC. (KR) 2008-06-19 US disclosed
US-20060188806-A1 Norbornene polymer for photoresist and photoresist composition comprising the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2006-08-24 US disclosed
US-20050090570-A1 Composition for forming dielectric film and method for forming dielectric film or pattern using the composition SAMSUNG ELECTRONICS CO., LTD. (KR) 2005-04-28 US disclosed