SCHEMBL28883156

SCHEMBL28883156

CC(O)Cc1ccc(Nc2ccccc2)cc1N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.44
MAPT P10636 10/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
RXFP1 Q9HBX9 1/20 0.44
CYP3A4 P08684 6/20 0.42
HSD17B10 Q99714 5/20 0.42
GAA P10253 5/20 0.42
ALOX12 P18054 4/20 0.42
TDP1 Q9NUW8 4/20 0.42
TSHR P16473 4/20 0.42
ALOX15 P16050 4/20 0.42
LMNA P02545 3/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
THRB P10828 3/20 0.42
KDM4E B2RXH2 2/20 0.42
RECQL P46063 2/20 0.42
GFER P55789 2/20 0.42
ATM Q13315 1/20 0.42
CYP1A2 P05177 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
SCHEMBL28883162 0.88 ALDH1A1 (0.44) ALDH1A1MAPTMEN1KMT2ARXFP1
SCHEMBL28868266 0.78 ALDH1A1 (0.47) ALDH1A1MAPTMEN1KMT2ARXFP1
SCHEMBL9652406 0.75 ALDH1A1 (0.52) ALDH1A1MAPTMEN1KMT2ARXFP1
SCHEMBL3895691 0.75 ALDH1A1 (0.46) ALDH1A1MAPTMEN1KMT2ARXFP1
SCHEMBL10854027 0.73 NOS2 (0.42) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL16197829 0.73 FDPS (0.39) CYP3A4TSHRALOX15LMNASLC6A2
SCHEMBL4931748 0.73 FDPS (0.39) CYP3A4TSHRALOX15LMNASLC6A2
SCHEMBL8566756 0.72 NOS2 (0.49) ALDH1A1CYP3A4HSD17B10TDP1ALOX15
SCHEMBL5088671 0.70 ALDH1A1 (0.60) ALDH1A1MAPTMEN1KMT2ACYP3A4
Diphenylamine SCHEMBL11002954 0.70 HSD17B10 (0.67) ALDH1A1MAPTMEN1KMT2ARXFP1

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
CN-109153934-B Polyester dispersants, synthesis and uses thereof 雪佛龙奥伦耐有限责任公司 2022-04-05 CN disclosed