SCHEMBL28384802

SCHEMBL28384802

CCCC(=O)Oc1cccc2nc3ccccc3nc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 4/20 0.53
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
KDM4E B2RXH2 3/20 0.44
RECQL P46063 1/20 0.44
ALDH1A1 P00352 5/20 0.44
MAPT P10636 6/20 0.42
POLB P06746 3/20 0.42
ACHE P22303 1/20 0.42
RAB9A P51151 4/20 0.41
THRB P10828 1/20 0.41
BLM P54132 1/20 0.41
CASP6 P55212 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TOP2A P11388 2/20 0.41
GAA P10253 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
LMNA P02545 2/20 0.41
NPC1 O15118 1/20 0.41
G6PD P11413 1/20 0.41

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
SCHEMBL28567770 0.80 NQO2 (0.61) NQO2KMT2AMEN1KDM4EALDH1A1
SCHEMBL6213177 0.79 NQO2 (0.59) NQO2KMT2AMEN1KDM4EALDH1A1
SCHEMBL9312497 0.79 KMT2A (0.59) KMT2AMEN1KDM4ERECQLALDH1A1
SCHEMBL317958 0.78 NQO2 (0.58) NQO2KMT2AMEN1KDM4EALDH1A1
SCHEMBL8940303 0.78 NQO2 (0.54) NQO2KMT2AMEN1KDM4EALDH1A1
SCHEMBL28092677 0.77 NQO2 (0.53) NQO2KMT2AMEN1KDM4EALDH1A1
SCHEMBL10751742 0.77 LMNA (0.60) KMT2AMEN1KDM4EALDH1A1MAPT
SCHEMBL447135 0.76 ALDH1A1 (0.58) KMT2AMEN1KDM4ERECQLALDH1A1
SCHEMBL29373398 0.76 ALDH1A1 (0.58) KMT2AMEN1KDM4ERECQLALDH1A1
SCHEMBL30914171 0.75 BCHE (0.52) NQO2KMT2AMEN1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110892320-B Electro-optical device with transparent ion exchange membrane 金泰克斯公司 2022-05-10 CN disclosed
CN-110892320-A Electro-optical device with transparent ion exchange membrane 金泰克斯公司 2020-03-17 CN disclosed