SCHEMBL29501294

SCHEMBL29501294

CC(Cc1ccc(Sc2ccccc2)cc1)=NOC(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
CDK5 Q00535 3/20 0.44
CDK5R1 Q15078 3/20 0.44
PKM P14618 3/20 0.44
MAPT P10636 3/20 0.44
NPC1 O15118 5/20 0.41
RAB9A P51151 5/20 0.41
MITF O75030 1/20 0.41
RBBP9 O75884 1/20 0.40
KLF5 Q13887 2/20 0.40
TNF P01375 1/20 0.40
NOD1 Q9Y239 1/20 0.40
NR2F2 P24468 1/20 0.39
PAX8 Q06710 1/20 0.39
XDH P47989 2/20 0.39
KMT2A Q03164 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
SCHEMBL29620218 0.87 SMN1; SMN2 (0.53) ALDH1A1SMN1; SMN2CDK5CDK5R1PKM
SCHEMBL17430666 0.84 ALDH1A1 (0.43) ALDH1A1HPGDSMN1; SMN2CDK5CDK5R1
SCHEMBL13006676 0.78 KMT2A (0.55) ALDH1A1HPGDSMN1; SMN2CDK5CDK5R1
SCHEMBL92109 0.78 KMT2A (0.55) ALDH1A1HPGDSMN1; SMN2CDK5CDK5R1
SCHEMBL9967316 0.78 KMT2A (0.55) ALDH1A1HPGDSMN1; SMN2CDK5CDK5R1
SCHEMBL91995 0.77 ALDH1A1 (0.51) ALDH1A1HPGDSMN1; SMN2CDK5CDK5R1
SCHEMBL16279024 0.77 ALDH1A1 (0.51) ALDH1A1HPGDSMN1; SMN2CDK5CDK5R1
SCHEMBL29501293 0.77 MAPT (0.51) ALDH1A1HPGDSMN1; SMN2CDK5CDK5R1
SCHEMBL625822 0.76 ALDH1A1 (0.50) ALDH1A1HPGDSMN1; SMN2CDK5CDK5R1
SCHEMBL14429957 0.75 ALDH1A1 (0.45) ALDH1A1HPGDSMN1; SMN2CDK5CDK5R1

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-111868176-B Compound, colored resin composition, color filter and display device 东友精细化工有限公司 2022-05-10 CN disclosed