SCHEMBL927741

SCHEMBL927741

CC[S+](CC)c1ccccc1.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
CYP3A4 P08684 4/20 0.47
LMNA P02545 2/20 0.47
CYP2D6 P10635 2/20 0.47
MAPK1 P28482 1/20 0.47
THPO P40225 1/20 0.47
ALDH1A1 P00352 4/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
CA12 O43570 3/20 0.42
CA9 Q16790 3/20 0.42
CYP1A2 P05177 2/20 0.42
BCHE P06276 1/20 0.42
ACHE P22303 1/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RECQL P46063 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL7133269 0.82 CA12 (0.47) CYP3A4LMNACYP2D6MAPK1THPO
SCHEMBL64189 0.82 CA12 (0.47) CYP3A4LMNACYP2D6MAPK1THPO
SCHEMBL3839710 0.80 CA12 (0.46) CYP3A4LMNACYP2D6MAPK1THPO
SCHEMBL3144525 0.80 CA12 (0.46) CYP3A4LMNACYP2D6MAPK1THPO
SCHEMBL64621 0.80 CA12 (0.46) CYP3A4LMNACYP2D6MAPK1THPO
P-Xylene SCHEMBL3404430 0.80 GAA (0.46) CYP3A4LMNACYP2D6MAPK1THPO
SCHEMBL2964104 0.80 CA12 (0.46) CYP3A4LMNACYP2D6MAPK1THPO
SCHEMBL11347502 0.80 CYP3A4 (0.45) CYP3A4LMNACYP2D6MAPK1THPO
SCHEMBL926758 0.80 GAA (0.48) CYP3A4LMNACYP2D6MAPK1THPO
SCHEMBL10418852 0.79 GAA (0.52) CYP3A4LMNACYP2D6MAPK1THPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1788436-B1 Rework process for photoresist film SHINETSU CHEMICAL CO (JP) 2013-01-09 EP disclosed
US-7868407-B2 Substrate comprising a lower silicone resin film and an upper silicone resin film SHIN-ETSU CHEMICAL CO., LTD. (JP) 2011-01-11 US disclosed
US-7642043-B2 Rework process for photoresist film SHIN-ETSU CHEMICAL CO., LTD. (JP) 2010-01-05 US disclosed
US-7638268-B2 Rework process for photoresist film SHIN-ESTU CHEMICAL CO., LTD. (JP) 2009-12-29 US disclosed
EP-1788437-B1 Rework process for photoresist film SHINETSU CHEMICAL CO (JP) 2009-12-23 EP disclosed
EP-1801619-B1 Substrate comprising two antireflective silicone resin layers between an organic layer and a photoresist layer, method for producing the same and patterning process using the same SHINETSU CHEMICAL CO (JP) 2008-08-06 EP disclosed
US-7303785-B2 Antireflective film material, and antireflective film and pattern formation method using the same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2007-12-04 US disclosed
EP-1801619-A2 Substrate, method for producing the same, and patterning process using the same Shin-Etsu Chemical Co., Ltd. (JP) 2007-06-27 EP disclosed
US-20070128886-A1 Substrate, method for producing the same, and patterning process using the same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2007-06-07 US disclosed
US-20070117411-A1 Rework process for photoresist film SHIN-ETSU CHEMICAL CO., LTD. (JP) 2007-05-24 US disclosed
EP-1788436-A1 Rework process for photoresist film Shin-Etsu Chemical Company, Ltd. (JP) 2007-05-23 EP disclosed
EP-1788437-A2 Rework process for photoresist film Shinetsu Chemical Co., Ltd. (JP) 2007-05-23 EP disclosed
US-20070111134-A1 solvent remove the first photoresist film, forming a second photoresist film over the second antireflection silicone resin film which is over the first antireflection silicone resin film; lower cost and provide an excellent resist pattern SHIN-ETSU CHEMICAL CO., LTD. (JP) 2007-05-17 US disclosed
US-20040253461-A1 Antireflective film material, and antireflective film and pattern formation method using the same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2004-12-16 US disclosed