SCHEMBL29634005

SCHEMBL29634005

CCn1c2ccccc2c2cc(-c3ccccc3)ccc21

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.63
MAPT P10636 3/20 0.63
MEN1 O00255 2/20 0.63
KMT2A Q03164 2/20 0.63
HTT P42858 2/20 0.63
ALDH1A1 P00352 2/20 0.63
MAPK1 P28482 2/20 0.63
HPGD P15428 1/20 0.63
HBB P68871 1/20 0.63
HSD17B10 Q99714 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
TSPO P30536 1/20 0.62
NPY5R Q15761 5/20 0.61
RAC2 P15153 1/20 0.56
RAC3 P60763 1/20 0.56
CDC42 P60953 1/20 0.56
RAC1 P63000 1/20 0.56
LMNA P02545 3/20 0.55
POLB P06746 2/20 0.54
PKM P14618 1/20 0.54

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
SCHEMBL4726399 1.00 KDM4E (0.63) KDM4EMAPTMEN1KMT2AHTT
SCHEMBL24667559 1.00 KDM4E (0.63) KDM4EMAPTMEN1KMT2AHTT
SCHEMBL11965565 0.97 KDM4E (0.59) KDM4EMAPTMEN1KMT2AHTT
SCHEMBL11965564 0.97 KDM4E (0.59) KDM4EMAPTMEN1KMT2AHTT
SCHEMBL13144269 0.97 KDM4E (0.59) KDM4EMAPTMEN1KMT2AHTT
SCHEMBL24667910 0.97 KDM4E (0.59) KDM4EMAPTMEN1KMT2AHTT
SCHEMBL29478496 0.96 MAPT (0.67) KDM4EMAPTMEN1KMT2AHTT
SCHEMBL19762118 0.96 MAPT (0.67) KDM4EMAPTMEN1KMT2AHTT
SCHEMBL14805532 0.95 MAPT (0.69) KDM4EMAPTMEN1KMT2AHTT
SCHEMBL3362461 0.95 TSPO (0.55) KDM4EMAPTMEN1KMT2AHTT

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-113214178-B 3-aryl substituted anthranilic anhydride derivative and preparation method thereof 广东工业大学 2022-05-13 CN disclosed