SCHEMBL9868151

SCHEMBL9868151

CCOCCN1c2ccccc2C(C)(C)C12C=Nc1c(ccc3ccncc13)O2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.55
THRB P10828 5/20 0.55
KDM4E B2RXH2 4/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
ALOX12 P18054 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
PKM P14618 2/20 0.55
LMNA P02545 4/20 0.51
GAA P10253 4/20 0.51
RECQL P46063 3/20 0.51
TDP1 Q9NUW8 3/20 0.51
ALDH1A1 P00352 2/20 0.51
HPGD P15428 2/20 0.51
HTT P42858 2/20 0.51
POLB P06746 1/20 0.51
MAPK1 P28482 1/20 0.51
NPSR1 Q6W5P4 3/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 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
SCHEMBL9866755 0.91 MAPT (0.56) MAPTTHRBKDM4ESMN1; SMN2ALOX12
SCHEMBL14077749 0.90 MAPT (0.68) MAPTTHRBKDM4ESMN1; SMN2ALOX12
SCHEMBL9867691 0.89 MAPT (0.54) MAPTTHRBKDM4ESMN1; SMN2ALOX12
SCHEMBL9868422 0.88 MAPT (0.57) MAPTTHRBKDM4ESMN1; SMN2ALOX12
SCHEMBL9802107 0.88 MAPT (0.59) MAPTTHRBKDM4ESMN1; SMN2ALOX12
SCHEMBL9868231 0.88 MAPT (0.56) MAPTTHRBKDM4ESMN1; SMN2ALOX12
SCHEMBL8907744 0.87 MAPT (0.56) MAPTTHRBKDM4ESMN1; SMN2ALOX12
SCHEMBL8909435 0.87 MAPT (0.56) MAPTTHRBKDM4ESMN1; SMN2ALOX12
SCHEMBL8908836 0.87 MAPT (0.56) MAPTTHRBKDM4ESMN1; SMN2ALOX12
SCHEMBL8908000 0.87 MAPT (0.56) MAPTTHRBKDM4ESMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5017698-A Spirooxazine photochromic compounds KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1991-05-21 US disclosed
EP-0350009-A1 Photochromic compound and photochromic composition KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1990-01-10 EP disclosed