SCHEMBL28937264

SCHEMBL28937264

NC(=O)OC(CO)C(Cc1ccccc1)c1c[nH]c2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
MAPT P10636 4/20 0.42
MGAM O43451 3/20 0.42
GAA P10253 3/20 0.42
SI P14410 3/20 0.42
MGAM2 Q2M2H8 3/20 0.42
PKM P14618 1/20 0.42
KDM4E B2RXH2 3/20 0.41
TSHR P16473 2/20 0.41
LMNA P02545 1/20 0.41
MPO P05164 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41
HIF1A Q16665 1/20 0.41
GPR84 Q9NQS5 2/20 0.41
ALDH1A1 P00352 3/20 0.40
CYP3A4 P08684 2/20 0.40
ALOX15 P16050 2/20 0.40
HSD17B10 Q99714 2/20 0.40

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
SCHEMBL28937263 1.00 MEN1 (0.42) MEN1KMT2AMAPTMGAMGAA
SCHEMBL31642219 0.78 KMT2A (0.53) MEN1KMT2AMAPTMGAMGAA
SCHEMBL31642547 0.78 KMT2A (0.53) MEN1KMT2AMAPTMGAMGAA
SCHEMBL31646013 0.78 KMT2A (0.53) MEN1KMT2AMAPTMGAMGAA
SCHEMBL31642403 0.78 KMT2A (0.53) MEN1KMT2AMAPTMGAMGAA
SCHEMBL31642357 0.78 KMT2A (0.53) MEN1KMT2AMAPTMGAMGAA
SCHEMBL29199765 0.73 KDM4E (0.58) MEN1KMT2AMAPTKDM4ETSHR
SCHEMBL29199770 0.73 KDM4E (0.58) MEN1KMT2AMAPTKDM4ETSHR
SCHEMBL9056837 0.73 CYP2D6 (0.61) MEN1KMT2AMAPTMGAMGAA
SCHEMBL10372734 0.73 GPR84 (0.47) MEN1KMT2AMAPTMGAMGAA

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-108299420-B Pentacyclic compounds as selective estrogen receptor down-regulators and uses thereof 南京圣和药业股份有限公司 2021-10-15 CN disclosed