SCHEMBL3402832

SCHEMBL3402832

CC(C)(C)OC(=O)COc1ccc2ccccc2c1[S+](c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 4/20 0.41
PRNP P04156 3/20 0.41
LMNA P02545 2/20 0.41
HPGD P15428 6/20 0.41
ALDH1A1 P00352 6/20 0.41
KDM4E B2RXH2 3/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPT P10636 5/20 0.39
NPSR1 Q6W5P4 3/20 0.39
POLB P06746 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP2C9 P11712 1/20 0.39
MAPK1 P28482 3/20 0.38
MITF O75030 1/20 0.38
HSP90AA1 P07900 1/20 0.38
PKM P14618 1/20 0.38
TLR9 Q9NR96 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
CTSD P07339 1/20 0.38
HSD17B10 Q99714 2/20 0.38

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
SCHEMBL30565756 1.00 RXFP1 (0.41) RXFP1PRNPLMNAHPGDALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL29700254 0.91 ACLY (0.38) RXFP1PRNPLMNAHPGDALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL51665 0.91 ACLY (0.38) RXFP1PRNPLMNAHPGDALDH1A1
SCHEMBL3189641 0.85 HPGD (0.43) LMNAHPGDALDH1A1KDM4ETDP1
SCHEMBL22610037 0.81 LMNA (0.47) RXFP1PRNPLMNAHPGDALDH1A1
SCHEMBL3190835 0.81 HPGD (0.40) LMNAHPGDALDH1A1KDM4ETDP1
SCHEMBL3193992 0.81 HPGD (0.40) LMNAHPGDALDH1A1KDM4ETDP1
SCHEMBL3204931 0.81 DDB1 (0.43) HPGDALDH1A1KDM4EMAPTNPSR1
SCHEMBL3190419 0.81 POLB (0.44) LMNAHPGDALDH1A1TDP1MAPT
SCHEMBL2624958 0.81 HPGD (0.40) RXFP1PRNPLMNAHPGDALDH1A1

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
EP-3613070-B1 PHOTOPATTERNABLE FILM UNIV CHICAGO (US) 2023-10-18 EP claimed
EP-3877787-A1 CONTACT LENS WITH A SURFACE COATING, AND MANUFACTURING METHOD Fachhochschule Kiel (DE) 2021-09-15 EP disclosed
EP-2255401-B1 NONWOVEN FABRIC HAVING CROSS-LINKING MATERIAL FREUDENBERG CARL KG (DE) 2015-04-01 EP disclosed
EP-2255401-A1 NONWOVEN FABRIC HAVING CROSS-LINKING MATERIAL Carl Freudenberg KG (DE) 2010-12-01 EP disclosed
WO-2009103537-A1 NONWOVEN FABRIC HAVING CROSS-LINKING MATERIAL CARL FREUDENBERG KG (DE) 2009-08-27 WO disclosed
US-7393623-B2 Incorporation of markings in optical media SPECTRA SYSTEMS CORPORATION (US) 2008-07-01 US disclosed