SCHEMBL7905044

SCHEMBL7905044

COc1ccc(OC)c(Nc2nnc(-c3ccc(Cl)cc3)c3ccccc23)c1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.55
LMNA P02545 2/20 0.54
KDR P35968 3/20 0.53
ALDH1A1 P00352 2/20 0.49
HPGD P15428 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
ENPP3 O14638 1/20 0.49
POLB P06746 2/20 0.48
PRNP P04156 1/20 0.48
RECQL P46063 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
USP2 O75604 1/20 0.47
GAA P10253 1/20 0.47
GFER P55789 1/20 0.47
THRB P10828 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL7914896 0.93 MAPT (0.58) MAPTLMNAKDRALDH1A1HPGD
SCHEMBL7904894 0.93 MAPT (0.62) MAPTLMNAKDRALDH1A1HPGD
SCHEMBL7913398 0.92 KDR (0.56) MAPTLMNAKDRALDH1A1HPGD
SCHEMBL7918610 0.91 MEN1 (0.56) MAPTLMNAKDRALDH1A1HPGD
SCHEMBL7904825 0.90 MAPT (0.63) MAPTLMNAKDRALDH1A1HPGD
SCHEMBL7913390 0.89 MAPT (0.56) MAPTLMNAKDRALDH1A1HPGD
SCHEMBL7914954 0.86 MAPT (0.57) MAPTLMNAKDRALDH1A1HPGD
SCHEMBL7914621 0.85 KDR (0.49) MAPTLMNAKDRALDH1A1HPGD
SCHEMBL7904898 0.85 MAPT (0.59) MAPTLMNAKDRALDH1A1HPGD
SCHEMBL7915149 0.85 MAPT (0.52) MAPTLMNAKDRALDH1A1HPGD

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