SCHEMBL13049481

SCHEMBL13049481

CC(C)(c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc(C(C)(C)c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
CYP3A4 P08684 4/20 0.52
ESR1 P03372 4/20 0.52
ESR2 Q92731 4/20 0.52
KDM4E B2RXH2 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
CYP2D6 P10635 2/20 0.50
CYP2C9 P11712 2/20 0.50
CYP2C19 P33261 2/20 0.50
CYP1A2 P05177 1/20 0.50
MAPT P10636 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
NR3C2 P08235 3/20 0.43
AR P10275 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
HTR6 P50406 1/20 0.42
ESRRG P62508 1/20 0.42

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
SCHEMBL17988507 1.00 ALDH1A1 (0.52) ALDH1A1CYP3A4ESR1ESR2KDM4E
SCHEMBL12153728 1.00 ALDH1A1 (0.52) ALDH1A1CYP3A4ESR1ESR2KDM4E
SCHEMBL1591676 0.98 ALDH1A1 (0.56) ALDH1A1CYP3A4ESR1ESR2KDM4E
SCHEMBL5424442 0.95 ESR1 (0.58) ALDH1A1CYP3A4ESR1ESR2KDM4E
SCHEMBL14129121 0.92 ALDH1A1 (0.45) ALDH1A1CYP3A4ESR1ESR2KDM4E
SCHEMBL26410551 0.90 ALDH1A1 (0.48) ALDH1A1CYP3A4ESR1ESR2KDM4E
SCHEMBL12191986 0.90 ESR1 (0.70) ALDH1A1CYP3A4ESR1ESR2KDM4E
SCHEMBL23763794 0.89 CYP3A4 (0.47) ALDH1A1CYP3A4ESR1ESR2KDM4E
SCHEMBL13700827 0.89 ESR1 (0.52) ALDH1A1CYP3A4ESR1ESR2KDM4E
SCHEMBL19440984 0.88 ALDH1A1 (0.42) ALDH1A1CYP3A4ESR1ESR2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10831118-B2 Electrophotographic photosensitive member and method for producing electrophotographic photosensitive member CANON KABUSHIKI KAISHA (JP) 2020-11-10 US disclosed
US-7839075-B2 Organic electroluminescent element, illuminator and display KONICA MINOLTA HOLDINGS, INC. (JP) 2010-11-23 US disclosed
US-7839075-B2 Organic electroluminescent element, illuminator and display KONICA MINOLTA HOLDINGS, INC. (JP) 2010-11-23 US disclosed
US-7485376-B2 Organic electroluminescent element, illuminator, and display KONICA MINOLTA HOLDINGS, INC. (JP) 2009-02-03 US disclosed
US-7485376-B2 Organic electroluminescent element, illuminator, and display KONICA MINOLTA HOLDINGS, INC. (JP) 2009-02-03 US disclosed