SCHEMBL8675147

SCHEMBL8675147

CC(C)c1ccc(N(c2ccc(-c3ccc(N)cc3)cc2)c2ccc(C(C)C)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
CYP3A4 P08684 5/20 0.50
TDP1 Q9NUW8 5/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
KDM4E B2RXH2 3/20 0.50
MAPT P10636 3/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
TP53 P04637 3/20 0.46
MAPK1 P28482 2/20 0.43
PSMD14 O00487 1/20 0.43
TSHR P16473 1/20 0.43
RECQL P46063 1/20 0.43
GFER P55789 1/20 0.43
ALOX15 P16050 1/20 0.43
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
HPGD P15428 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
SCHEMBL256589 0.87 ALDH1A1 (0.61) ALDH1A1CYP3A4TDP1L3MBTL1KDM4E
SCHEMBL8673666 0.85 GRIA4 (0.46) ALDH1A1CYP3A4TDP1L3MBTL1KDM4E
SCHEMBL27929329 0.84 ALDH1A1 (0.67) ALDH1A1CYP3A4TDP1L3MBTL1KDM4E
SCHEMBL4852052 0.84 ALDH1A1 (0.67) ALDH1A1CYP3A4TDP1L3MBTL1KDM4E
SCHEMBL12922764 0.84 TYR (0.44) ALDH1A1CYP3A4TDP1L3MBTL1KDM4E
SCHEMBL29215915 0.84 ALDH1A1 (0.67) ALDH1A1CYP3A4TDP1L3MBTL1KDM4E
SCHEMBL18805967 0.84 TYR (0.44) ALDH1A1CYP3A4TDP1L3MBTL1KDM4E
SCHEMBL20099084 0.83 ALDH1A1 (0.50) ALDH1A1CYP3A4TDP1L3MBTL1KDM4E
SCHEMBL18070181 0.83 PTGS2 (0.47) ALDH1A1CYP3A4TDP1L3MBTL1KDM4E
SCHEMBL8936350 0.83 ALDH1A1 (0.50) ALDH1A1CYP3A4TDP1L3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5828938-A Transferring device and image forming apparatus using the same MITA INDUSTRIAL CO., LTD. (JP) 1998-10-27 US disclosed