SCHEMBL9746576

SCHEMBL9746576

CC1(C)c2ccccc2N(CCc2ccccc2)C12C=Nc1c(ccc3ccccc13)O2

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.70
SMN1; SMN2 Q16637 7/20 0.70
THRB P10828 5/20 0.70
KDM4E B2RXH2 5/20 0.70
ALOX12 P18054 2/20 0.70
L3MBTL1 Q9Y468 2/20 0.70
PKM P14618 2/20 0.70
LMNA P02545 5/20 0.55
HTT P42858 4/20 0.55
GAA P10253 4/20 0.55
RECQL P46063 3/20 0.55
TDP1 Q9NUW8 3/20 0.55
ALDH1A1 P00352 2/20 0.55
HPGD P15428 2/20 0.55
MAPK1 P28482 2/20 0.55
POLB P06746 1/20 0.55
NPSR1 Q6W5P4 5/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45

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
SCHEMBL9746934 0.94 MAPT (0.68) MAPTSMN1; SMN2THRBKDM4EALOX12
SCHEMBL2399622 0.90 MAPT (0.70) MAPTSMN1; SMN2THRBKDM4EALOX12
SCHEMBL9868985 0.90 MAPT (0.56) MAPTSMN1; SMN2THRBKDM4EALOX12
SCHEMBL12410812 0.88 MAPT (0.73) MAPTSMN1; SMN2THRBKDM4EALOX12
SCHEMBL13619848 0.88 MAPT (0.73) MAPTSMN1; SMN2THRBKDM4EALOX12
SCHEMBL14427990 0.87 MAPT (0.72) MAPTSMN1; SMN2THRBKDM4EALOX12
SCHEMBL16363773 0.86 MAPT (0.74) MAPTSMN1; SMN2THRBKDM4EALOX12
SCHEMBL23169662 0.86 MAPT (0.68) MAPTSMN1; SMN2THRBKDM4EALOX12
SCHEMBL16315811 0.86 MAPT (0.70) MAPTSMN1; SMN2THRBKDM4EALOX12
SCHEMBL9061457 0.85 MAPT (0.67) MAPTSMN1; SMN2THRBKDM4EALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0171909-B1 SPIRO-OXAZINE COMPOUNDS AND PREPARATION THEREOF AND PHOTOCHROMIC SHAPED ARTICLE TORAY INDUSTRIES, INC. (JP) 1992-01-08 EP disclosed
US-4784474-A LENSES; WINDOWS TORAY INDUSTRIES, INC. (JP) 1988-11-15 US disclosed
EP-0171909-A1 Spiro-oxazine compounds and preparation thereof and photochromic shaped article TORAY INDUSTRIES, INC. (JP) 1986-02-19 EP disclosed