SCHEMBL3439007

SCHEMBL3439007

CN1c2ccc(O)cc2C(C)(C)C12C=Nc1c(ccc3ccccc13)O2

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.77
KDM4E B2RXH2 6/20 0.77
THRB P10828 4/20 0.77
SMN1; SMN2 Q16637 4/20 0.77
ALOX12 P18054 2/20 0.77
L3MBTL1 Q9Y468 2/20 0.77
PKM P14618 1/20 0.77
LMNA P02545 3/20 0.62
GAA P10253 3/20 0.62
HTT P42858 3/20 0.62
ALDH1A1 P00352 2/20 0.62
HPGD P15428 2/20 0.62
RECQL P46063 2/20 0.62
TDP1 Q9NUW8 2/20 0.62
MAPK1 P28482 2/20 0.62
POLB P06746 1/20 0.62
NPSR1 Q6W5P4 3/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51

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
SCHEMBL13104740 0.93 MAPT (0.64) MAPTKDM4ETHRBSMN1; SMN2ALOX12
SCHEMBL29566059 0.88 MAPT (0.78) MAPTKDM4ETHRBSMN1; SMN2ALOX12
SCHEMBL809230 0.88 MAPT (0.78) MAPTKDM4ETHRBSMN1; SMN2ALOX12
SCHEMBL4620865 0.88 MAPT (0.78) MAPTKDM4ETHRBSMN1; SMN2ALOX12
SCHEMBL29493005 0.88 MAPT (0.77) MAPTKDM4ETHRBSMN1; SMN2ALOX12
SCHEMBL1626757 0.88 MAPT (0.77) MAPTKDM4ETHRBSMN1; SMN2ALOX12
SCHEMBL14870331 0.88 MAPT (0.77) MAPTKDM4ETHRBSMN1; SMN2ALOX12
SCHEMBL80364 0.87 MAPT (1.00) MAPTKDM4ETHRBSMN1; SMN2ALOX12
SCHEMBL29493002 0.87 MAPT (1.00) MAPTKDM4ETHRBSMN1; SMN2ALOX12
SCHEMBL13839771 0.87 MAPT (1.00) MAPTKDM4ETHRBSMN1; SMN2ALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1560893-B1 PHOTOCHROMIC COMPOSITIONS AND LIGHT TRANSMISSIBLE ARTICLES ADVANCED POLYMERIK PTY LTD (AU) 2012-06-06 EP disclosed
US-7807075-B2 Photochromic compositions and light transmissible articles ADVANCED POLYMERIK PTY LTD (AU) 2010-10-05 US disclosed
EP-1560893-A4 PHOTOCHROMIC COMPOSITIONS AND LIGHT TRANSMISSIBLE ARTICLES POLYMERS AUSTRALIA PTY LTD (AU) 2008-06-04 EP disclosed
US-20080006798-A1 Photochromic Compositions and Light Transmissible Articles JAMES ROBINSON SPECIALITY INGREDIENTS LTD (GB) 2008-01-10 US disclosed
US-7247262-B2 Photochromic compositions and light transmissible articles POLYMERS AUSTRALIA PTY LTD. (AU) 2007-07-24 US disclosed
US-20050269556-A1 Photochromic compositions and light transmissible articles JAMES ROBINSON SPECIALITY INGREDIENTS LTD (GB) 2005-12-08 US disclosed
EP-1560893-A1 PHOTOCHROMIC COMPOSITIONS AND LIGHT TRANSMISSIBLE ARTICLES Polymers Australia PTY Limited (AU) 2005-08-10 EP disclosed
WO-2004041961-A1 PHOTOCHROMIC COMPOSITIONS AND LIGHT TRANSMISSIBLE ARTICLES POLYMERS AUSTRALIA PTY LIMITED (AU) 2004-05-21 WO disclosed