SCHEMBL21392004

SCHEMBL21392004

c1ccc(Sc2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
MAPT P10636 2/20 0.52
CYP3A4 P08684 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
KDM4E B2RXH2 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
MAOA P21397 3/20 0.46
MAOB P27338 3/20 0.46
HPGD P15428 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CRHBP P24387 1/20 0.43
ATM Q13315 1/20 0.43
CRHR2 Q13324 1/20 0.43
TLR9 Q9NR96 1/20 0.43
SLC6A4 P31645 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
SCHEMBL14018351 0.97 ALDH1A1 (0.54) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL8944002 0.97 ALDH1A1 (0.54) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL22163524 0.89 ALDH1A1 (0.46) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL8944073 0.87 ALDH1A1 (0.45) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL8944075 0.85 LTA4H (0.42) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL8943939 0.84 CA4 (0.45) ALDH1A1MAPTKDM4EHPGDMEN1
SCHEMBL3373930 0.84 HTR2C (0.44) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL23190392 0.83 ALDH1A1 (0.42) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL8943632 0.82 CA4 (0.46) ALDH1A1MAPTKDM4EHPGDMEN1
SCHEMBL8944222 0.82 CA4 (0.46) ALDH1A1MAPTMEN1KMT2APTGIR

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-11094474-B2 Photoelectric conversion element, dye-sensitized solar cell, metal complex dye, dye composition, and oxide semiconductor electrode FUJIFILM CORPORATION (JP) 2021-08-17 US disclosed
US-20190295779-A1 PHOTOELECTRIC CONVERSION ELEMENT, DYE-SENSITIZED SOLAR CELL, METAL COMPLEX DYE, DYE COMPOSITION, AND OXIDE SEMICONDUCTOR ELECTRODE FUJIFILM CORPORATION (JP) 2019-09-26 US disclosed