SCHEMBL28026397

SCHEMBL28026397

C=Cc1c(C(=O)OCC)c2ccccc2n1Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.56
GAA P10253 3/20 0.56
LMNA P02545 2/20 0.56
MAPT P10636 2/20 0.56
PKM P14618 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.50
ALDH1A1 P00352 3/20 0.49
POLB P06746 1/20 0.49
TSHR P16473 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
HPGD P15428 1/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
HSD17B10 Q99714 1/20 0.47
F2RL3 Q96RI0 1/20 0.47
TDP2 O95551 1/20 0.47
NSD2 O96028 1/20 0.47
PLCG1 P19174 1/20 0.47
PAX8 Q06710 1/20 0.47
MAPK1 P28482 1/20 0.46

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
SCHEMBL28026390 0.88 KDM4E (0.60) KDM4EGAALMNAMAPTSMN1; SMN2
SCHEMBL28026401 0.87 MAPT (0.58) KDM4EGAALMNAMAPTPKM
SCHEMBL3388130 0.84 MAPT (0.76) KDM4EGAALMNAMAPTPKM
SCHEMBL28025828 0.81 ALDH1A1 (0.59) KDM4EGAALMNAMAPTSMN1; SMN2
SCHEMBL14848270 0.80 KDM4E (0.66) KDM4EGAALMNAMAPTPKM
SCHEMBL10635597 0.79 KDM4E (0.56) KDM4EGAALMNAMAPTPKM
SCHEMBL1522936 0.77 KDM4E (0.81) KDM4EGAALMNAMAPTPKM
SCHEMBL18582662 0.77 L3MBTL1 (0.71) KDM4EGAALMNAMAPTPKM
SCHEMBL17625298 0.76 F10 (0.58) KDM4EGAALMNAMAPTPKM
SCHEMBL26310031 0.75 CYP19A1 (0.58) KDM4EGAALMNAMAPTPKM

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-104945303-A Preparation method of 3-alkenyl indole compound UNIV ZHEJIANG TECHNOLOGY 2015-09-30 CN disclosed