SCHEMBL9901278

SCHEMBL9901278

Cc1cc(Sc2ccccc2)cc(C)c1-c1c(C)cc(Sc2ccccc2)cc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.43
TP53 P04637 1/20 0.43
HPGD P15428 4/20 0.42
ALDH1A1 P00352 3/20 0.42
MAOA P21397 3/20 0.40
MAOB P27338 3/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HTR2C P28335 2/20 0.38
HTR6 P50406 1/20 0.38
SLC6A4 P31645 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MGLL Q99685 1/20 0.38
HSD17B10 Q99714 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
HTR1A P08908 1/20 0.36
HTR3A P46098 1/20 0.36
MMP1 P03956 1/20 0.35
MMP9 P14780 1/20 0.35
MMP13 P45452 1/20 0.35

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
SCHEMBL11887379 0.86 ALDH1A1 (0.42) MAPTTP53HPGDALDH1A1MAOA
SCHEMBL12429542 0.82 MEN1 (0.50) MAPTTP53HPGDALDH1A1MAOA
SCHEMBL11387744 0.80 MAOA (0.42) MAPTTP53HPGDALDH1A1MAOA
SCHEMBL10007323 0.79 ALDH1A1 (0.47) MAPTTP53HPGDALDH1A1MAOA
SCHEMBL6947110 0.79 MAOA (0.50) MAPTHPGDALDH1A1MAOAMAOB
SCHEMBL16313685 0.79 HTR2C (0.38) MAPTTP53HPGDALDH1A1MAOA
SCHEMBL4804097 0.78 ALDH1A1 (0.43) MAPTTP53HPGDALDH1A1MAOA
SCHEMBL10597213 0.77 CYP3A4 (0.61) MAPTALDH1A1MEN1KMT2AHTT
Diphenylsulfane SCHEMBL27500092 0.76 HPGD (0.54) MAPTHPGDALDH1A1MAOAMAOB
SCHEMBL12795608 0.76 MAOA (0.44) MAPTTP53HPGDALDH1A1MAOA

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-20140061545-A1 BIS(SULFONYL)BIARYL DERIVATIVES AS ELECTRON TRANSPORTING AND/OR HOST MATERIALS GEORGIA TECH RESEARCH CORPORATION 2014-03-06 US disclosed
US-20140061545-A1 BIS(SULFONYL)BIARYL DERIVATIVES AS ELECTRON TRANSPORTING AND/OR HOST MATERIALS GEORGIA TECH RESEARCH CORPORATION 2014-03-06 US disclosed
US-20140061545-A1 BIS(SULFONYL)BIARYL DERIVATIVES AS ELECTRON TRANSPORTING AND/OR HOST MATERIALS GEORGIA TECH RESEARCH CORPORATION 2014-03-06 US disclosed
EP-2649150-A2 BIS(SULFONYL)BIARYL DERIVATIVES AS ELECTRON TRANSPORTING AND/OR HOST MATERIALS Georgia Tech Research Corporation (US) 2013-10-16 EP disclosed
WO-2012078770-A2 BIS(SULFONYL)BIARYL DERIVATIVES AS ELECTRON TRANSPORTING AND/OR HOST MATERIALS GEORGIA TECH RESEARCH CORPORATION (US) 2012-06-14 WO disclosed
WO-2012078770-A2 BIS(SULFONYL)BIARYL DERIVATIVES AS ELECTRON TRANSPORTING AND/OR HOST MATERIALS GEORGIA TECH RESEARCH CORPORATION (US) 2012-06-14 WO disclosed