SCHEMBL9998263

SCHEMBL9998263

C(=C/[Sn](c1ccccc1)(c1ccccc1)c1ccccc1)\c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.48
ALDH1A1 P00352 2/20 0.41
LMNA P02545 2/20 0.41
MAPK1 P28482 2/20 0.41
NFE2L2 Q16236 2/20 0.41
CYP19A1 P11511 2/20 0.41
MAOA P21397 2/20 0.41
TRPA1 O75762 2/20 0.41
ALOX5 P09917 1/20 0.41
MAPT P10636 2/20 0.39
RECQL P46063 2/20 0.39
HDAC3 O15379 1/20 0.39
TNKS O95271 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HCAR2 Q8TDS4 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39

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
SCHEMBL9998267 1.00 MAOB (0.48) MAOBALDH1A1LMNAMAPK1NFE2L2
SCHEMBL6655700 0.81 ALDH1A1 (0.38) MAOBALDH1A1LMNAMAPK1MAPT
SCHEMBL6655705 0.81 ALDH1A1 (0.38) MAOBALDH1A1LMNAMAPK1MAPT
SCHEMBL5951569 0.72 MAOB (0.50) MAOBALDH1A1LMNAMAPK1NFE2L2
SCHEMBL5951572 0.72 MAOB (0.50) MAOBALDH1A1LMNAMAPK1NFE2L2
SCHEMBL30631956 0.72 ALDH1A1 (0.31) ALDH1A1LMNA
(Z)-1,2-Diphenylethene SCHEMBL22712863 0.71 MAOB (0.73) MAOBALDH1A1LMNAMAPK1NFE2L2
(Z)-1,2-Diphenylethene SCHEMBL21847984 0.71 MAOB (0.73) MAOBALDH1A1LMNAMAPK1NFE2L2
(Z)-1,2-Diphenylethene SCHEMBL9134305 0.71 MAOB (0.73) MAOBALDH1A1LMNAMAPK1NFE2L2
(Z)-1,2-Diphenylethene SCHEMBL9488270 0.71 MAOB (0.73) MAOBALDH1A1LMNAMAPK1NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8698086-B2 High effective atomic number polymer scintillators for gamma ray spectroscopy LAWRENCE LIVERMORE NATIONAL SECURITY, LLC (US) 2014-04-15 US disclosed
US-20110315885-A1 HIGH EFFECTIVE ATOMIC NUMBER POLYMER SCINTILLATORS FOR GAMMA RAY SPECTROSCOPY LAWRENCE LIVERMORE NATIONAL SECURITY, LLC (US) 2011-12-29 US disclosed