SCHEMBL19364971

SCHEMBL19364971

CCCCOC(=O)n1c2ccccc2c(=O)c2[nH]c3ccccc3c(=O)c21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.47
ALDH1A1 P00352 6/20 0.47
TSHR P16473 6/20 0.47
HSD17B10 Q99714 4/20 0.45
MAPK1 P28482 2/20 0.44
NTRK1 P04629 1/20 0.44
LMNA P02545 1/20 0.44
HPGD P15428 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
CYP2D6 P10635 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
POLB P06746 1/20 0.38

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
SCHEMBL17897787 0.80 CHRM2 (0.41) KDM4EALDH1A1HSD17B10NTRK1LMNA
SCHEMBL14397210 0.79 GAA (0.45) KDM4EALDH1A1TSHRHSD17B10MAPK1
SCHEMBL22837272 0.73 NTRK1 (0.45) KDM4EALDH1A1TSHRHSD17B10NTRK1
SCHEMBL14397205 0.71 ALDH1A1 (0.42) KDM4EALDH1A1HSD17B10NTRK1LMNA
SCHEMBL14397606 0.67 ALDH1A1 (0.51) KDM4EALDH1A1TSHRNTRK1HPGD
SCHEMBL9124136 0.67 KDM4E (0.58) KDM4EALDH1A1TSHRHSD17B10MAPK1
SCHEMBL8480082 0.67 KMT2A (0.49) KDM4EALDH1A1TSHRHSD17B10MAPK1
SCHEMBL9394723 0.66 CDK4 (0.57) KDM4EALDH1A1HSD17B10NTRK1LMNA
SCHEMBL8412387 0.66 HTR6 (0.65) KDM4EALDH1A1TSHRHSD17B10LMNA
SCHEMBL31486077 0.66 ALDH1A1 (0.57) KDM4EALDH1A1TSHRHSD17B10MAPK1

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
US-9768383-B2 Method for applying an organic semiconductor layer based on epindolidione to a carrier UNIVERSITAET LINZ (AT) 2017-09-19 US disclosed