SCHEMBL21028368

SCHEMBL21028368

CN1C(=O)c2ccc(C(=O)C#Cc3ccccc3)cc2C1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VCP P55072 1/20 0.57
ALDH1A1 P00352 7/20 0.52
KMT2A Q03164 5/20 0.47
POLB P06746 2/20 0.47
MEN1 O00255 4/20 0.46
HSP90AA1 P07900 2/20 0.46
MAPT P10636 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
MITF O75030 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
OPRK1 P41145 1/20 0.46
APP P05067 1/20 0.44
NR1H2 P55055 2/20 0.44
NR1H3 Q13133 2/20 0.44
TSHR P16473 1/20 0.43
ATM Q13315 1/20 0.43
GRM5 P41594 1/20 0.42
HPGD P15428 1/20 0.42
RXFP1 Q9HBX9 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
SCHEMBL2574360 0.85 MEN1 (0.55) VCPALDH1A1KMT2APOLBMEN1
SCHEMBL14694230 0.83 HSD17B10 (0.50) VCPALDH1A1KMT2APOLBMEN1
SCHEMBL2484619 0.78 VCP (0.54) VCPALDH1A1KMT2AMEN1HSP90AA1
SCHEMBL83864 0.77 GRM5 (0.60) ALDH1A1KMT2AMEN1MAPTAPP
SCHEMBL14867189 0.77 VCP (0.53) VCPALDH1A1KMT2APOLBMEN1
SCHEMBL3942594 0.75 ALDH1A1 (0.67) ALDH1A1KMT2APOLBMEN1NPSR1
SCHEMBL28258928 0.75 VCP (0.50) VCPALDH1A1KMT2APOLBMEN1
SCHEMBL22627210 0.75 PTGES (0.49) VCPALDH1A1KMT2APOLBMEN1
SCHEMBL10625119 0.75 VCP (0.81) VCPALDH1A1KMT2AMEN1HSP90AA1
SCHEMBL15827958 0.74 VCP (1.00) VCPALDH1A1KMT2AMEN1HSP90AA1

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-20190163061-A1 POLYIMIDE PRECURSOR AND LITHOGRAPHY PATTERN FORMED BY THE SAME TAIFLEX SCIENTIFIC CO., LTD. (TW) 2019-05-30 US disclosed