SCHEMBL2590249

SCHEMBL2590249

Cc1cc(C)c(N2CCN(c3c(C)cc(C)cc3C)C2=[Ru](Cl)Cl)c(C)c1.c1ccc(C(c2ccccn2)c2ccccn2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 2/20 0.44
SLC6A2 P23975 2/20 0.44
SLC6A4 P31645 2/20 0.44
ALDH1A1 P00352 3/20 0.35
CHRM2 P08172 2/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
OPRK1 P41145 2/20 0.33
KDM4E B2RXH2 2/20 0.33
LMNA P02545 2/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRL1 P41146 1/20 0.33
ABCB11 O95342 1/20 0.33
ESR1 P03372 1/20 0.33
CYP3A4 P08684 1/20 0.33
ADRA2A P08913 1/20 0.33
CYP2C9 P11712 1/20 0.33

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
SCHEMBL2591237 0.83 MEN1 (0.31) ALDH1A1MEN1KMT2A
SCHEMBL30693642 0.77 SLC6A2 (0.37) SLC6A3SLC6A2SLC6A4ALDH1A1
SCHEMBL1662433 0.75 ALDH1A1 (0.34) ALDH1A1KDM4ENPSR1MAPTHTT
SCHEMBL17267904 0.69 ALDH1A1 (0.33) ALDH1A1KDM4ELMNATSHRMEN1
SCHEMBL30095352 0.69
SCHEMBL10154156 0.69 SLC6A2 (0.91) SLC6A3SLC6A2SLC6A4ALDH1A1CHRM2
SCHEMBL30166037 0.69 SLC6A2 (0.91) SLC6A3SLC6A2SLC6A4ALDH1A1CHRM2
SCHEMBL12915346 0.67 MAPT (0.51) SLC6A3SLC6A2SLC6A4ALDH1A1OPRK1
SCHEMBL15854855 0.67 SLC6A3 (0.78) SLC6A3SLC6A2SLC6A4ALDH1A1CHRM2
SCHEMBL31226864 0.66 MEN1 (0.32) ALDH1A1LMNATSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10351727-B2 Copolymer formulation for directed self-assembly, methods of manufacture thereof and articles comprising the same DOW GLOBAL TECHNOLOGIES LLC (US) 2019-07-16 US disclosed
US-9840637-B2 Copolymer formulation for directed self-assembly, methods of manufacture thereof and articles comprising the same DOW GLOBAL TECHNOLOGIES LLC (US) 2017-12-12 US disclosed
US-9772554-B2 Copolymer formulation for directed self-assembly, methods of manufacture thereof and articles comprising the same DOW GLOBAL TECHNOLOGIES LLC (US) 2017-09-26 US disclosed
US-9765214-B2 Copolymer formulation for directed self-assembly, methods of manufacture thereof and articles comprising the same THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-09-19 US disclosed
US-20160254141-A1 COPOLYMER FORMULATION FOR DIRECTED SELF-ASSEMBLY, METHODS OF MANUFACTURE THEREOF AND ARTICLES COMPRISING THE SAME THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2016-09-01 US disclosed
US-20160251539-A1 COPOLYMER FORMULATION FOR DIRECTED SELF-ASSEMBLY, METHODS OF MANUFACTURE THEREOF AND ARTICLES COMPRISING THE SAME THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2016-09-01 US disclosed
US-20160251508-A1 COPOLYMER FORMULATION FOR DIRECTED SELF-ASSEMBLY, METHODS OF MANUFACTURE THEREOF AND ARTICLES COMPRISING THE SAME THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2016-09-01 US disclosed
US-20160251538-A1 COPOLYMER FORMULATION FOR DIRECTED SELF-ASSEMBLY, METHODS OF MANUFACTURE THEREOF AND ARTICLES COMPRISING THE SAME THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2016-09-01 US disclosed
WO-2011135029-A1 METATHESIS CROSSLINKABLE COATING COMPOSITIONS DSM IP ASSETS B.V. (NL) 2011-11-03 WO disclosed