SCHEMBL3759525

SCHEMBL3759525

C[S+](C)c1ccc(O)c2ccc(O)cc12.Cc1ccc(S(=O)(=O)[O-])cc1

nearest known ligand 0.47

Known targets — ChEMBL curated mechanism

CHRM1CHRM2CHRM3CHRM4CHRM5SLC6A2dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
GAA P10253 3/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
EP300 Q09472 1/20 0.39
KAT2B Q92831 1/20 0.39
KAT8 Q9H7Z6 1/20 0.39
PTGS1 P23219 1/20 0.39
CYTH2 Q99418 1/20 0.38
ALDH1A1 P00352 2/20 0.37
LMNA P02545 2/20 0.37
TP53 P04637 1/20 0.37
P4HB P07237 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
PAX8 Q06710 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PKM P14618 1/20 0.36
HKDC1 Q2TB90 1/20 0.36

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
SCHEMBL1130239 0.85 EP300 (0.51) KMT2AMEN1GAAESR1ESR2
SCHEMBL29420741 0.81 ALDH1A1 (0.41) ESR1ESR2ALDH1A1LMNAHSD17B10
SCHEMBL794898 0.81 ALDH1A1 (0.41) ESR1ESR2ALDH1A1LMNAHSD17B10
Trifluoromethanesulfonic Acid SCHEMBL3287537 0.81 PTGS1 (0.37) KMT2AMEN1GAAESR1ESR2
Trifluoromethanesulfonic Acid SCHEMBL29353026 0.81 PTGS1 (0.37) KMT2AMEN1GAAESR1ESR2
SCHEMBL3766321 0.81 NAPRT (0.38) KMT2AGAAPTGS1CYP1A2CYP2C9
Hydrochloric Acid SCHEMBL31497694 0.80 ALDH1A1 (0.39) ESR1ESR2ALDH1A1LMNAHSD17B10
Hydrochloric Acid SCHEMBL31497693 0.80 ALDH1A1 (0.39) ESR1ESR2ALDH1A1LMNAHSD17B10
Trifluoromethanesulfonic Acid SCHEMBL3287542 0.77 HSD17B10 (0.34) GAAESR1ESR2PTGS1ALDH1A1
SCHEMBL19469378 0.76 ESR1 (0.33) ESR1ESR2PTGS1ALDH1A1LMNA

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-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
EP-1601729-B1 INK JET INK COMPOSITION AND METHOD FOR SECURITY MAKING VIDEOJET TECHNOLOGIES INC (US) 2006-06-21 EP 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