SCHEMBL2013580

SCHEMBL2013580

CN(C)c1cc[n+](C)c(C=Cc2ccccc2)c1.Cc1ccc(S(=O)(=O)[O-])cc1

nearest known ligand 0.43

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
MEN1 O00255 7/20 0.43
KMT2A Q03164 7/20 0.43
RAB9A P51151 4/20 0.43
NPC1 O15118 3/20 0.43
APOBEC3A P31941 2/20 0.43
APOBEC3G Q9HC16 2/20 0.43
GFER P55789 2/20 0.43
GAA P10253 1/20 0.43
ALDH1A1 P00352 4/20 0.40
HTT P42858 4/20 0.40
RELA Q04206 1/20 0.38
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37
INSR P06213 1/20 0.37
CHAT P28329 3/20 0.36
CNR2 P34972 1/20 0.36
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
POLB P06746 2/20 0.36
NPSR1 Q6W5P4 2/20 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
SCHEMBL8740741 0.88 RELA (0.44) MEN1KMT2ARAB9ANPC1APOBEC3A
SCHEMBL8740701 0.83 MEN1 (0.56) MEN1KMT2ARAB9ANPC1APOBEC3A
SCHEMBL8740680 0.82 PPARG (0.40) MEN1KMT2ANPC1ALDH1A1HTT
SCHEMBL11386724 0.82 RAB9A (0.51) MEN1KMT2ARAB9ANPC1APOBEC3A
SCHEMBL11386719 0.82 RAB9A (0.51) MEN1KMT2ARAB9ANPC1APOBEC3A
SCHEMBL7178000 0.81 HTT (0.42) MEN1KMT2ARAB9ANPC1APOBEC3A
SCHEMBL372527 0.79 CHAT (0.61) MEN1KMT2ARAB9ANPC1APOBEC3A
SCHEMBL531127 0.77 MEN1 (0.63) MEN1KMT2ARAB9ANPC1APOBEC3A
SCHEMBL531126 0.77 MEN1 (0.63) MEN1KMT2ARAB9ANPC1APOBEC3A
SCHEMBL11384770 0.74 RAB9A (0.51) MEN1KMT2ARAB9ANPC1APOBEC3A

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-6563622-B2 High-speed communications system TERABIT COMMUNICATIONS, L.L.C. 2003-05-13 US claimed
CN-101377465-B Inspection apparatus and inspection method using terahertz waves CANON KK 2011-11-09 CN disclosed
US-7963168-B2 Inspection apparatus and inspection method using electromagnetic wave CANON KABUSHIKI KAISHA (JP) 2011-06-21 US disclosed
US-20090056455-A1 INSPECTION APPARATUS AND INSPECTION METHOD USING ELECTROMAGNETIC WAVE CANON KABUSHIKI KAISHA (JP) 2009-03-05 US disclosed
EP-2031375-A2 Inspection apparatus and inspection method using terahertz waves Canon Kabushiki Kaisha (JP) 2009-03-04 EP disclosed
CN-101377465-A Inspection apparatus and inspection method using terahertz waves CANON KK (JP) 2009-03-04 CN disclosed
US-7387913-B2 3D optoelectronic micro system JSR CORPORATION (JP) 2008-06-17 US disclosed
US-20060261432-A1 3D optoelectronic micro system JSR CORPORATION (JP) 2006-11-23 US disclosed
US-20040247236-A1 Three-Dimensional opto-electronic micro-system YOSHIMURA, TETSUZO (JP) 2004-12-09 US disclosed