SCHEMBL7911801

SCHEMBL7911801

CCOC(=O)c1ccc(-c2nnc(Nc3cc(OC)ccc3OC)c3ccccc23)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHMT2 P34897 1/20 0.59
MAPT P10636 8/20 0.55
KDR P35968 5/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
RXFP1 Q9HBX9 1/20 0.51
ALDH1A1 P00352 4/20 0.50
HPGD P15428 2/20 0.50
HTT P42858 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
KDM4E B2RXH2 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
POLB P06746 3/20 0.49
NPC1 O15118 1/20 0.49
THRB P10828 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
HSD17B10 Q99714 1/20 0.48
LMNA P02545 1/20 0.48

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
SCHEMBL7918457 0.90 MEN1 (0.60) SHMT2MAPTKDRMEN1KMT2A
SCHEMBL7904898 0.87 MAPT (0.59) SHMT2MAPTKDRMEN1KMT2A
SCHEMBL7912018 0.85 KDR (0.74) MAPTKDRMEN1KMT2ARXFP1
SCHEMBL7904894 0.85 MAPT (0.62) MAPTKDRMEN1KMT2AALDH1A1
SCHEMBL7904825 0.84 MAPT (0.63) MAPTKDRMEN1KMT2AALDH1A1
SCHEMBL7918610 0.82 MEN1 (0.56) MAPTKDRMEN1KMT2ARXFP1
SCHEMBL7915149 0.81 MAPT (0.52) MAPTKDRMEN1KMT2AALDH1A1
SCHEMBL7905044 0.81 MAPT (0.55) MAPTKDRMEN1KMT2AALDH1A1
SCHEMBL7913390 0.81 MAPT (0.56) MAPTKDRMEN1KMT2ARXFP1
SCHEMBL7912171 0.81 KDR (0.62) MAPTKDRMEN1KMT2ARXFP1

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-6207666-B1 TREATING PRECANCEROUS LESIONS BY ADMINISTERING 4-PHENYLPHTHALAZINE DERIVATIVE CELL PATHWAYS, INC. 2001-03-27 US disclosed