SCHEMBL7918649

SCHEMBL7918649

COc1ccc(OC)c(Nc2nnc(-c3ccc(C)cc3)c3cc(C)c(C)cc23)c1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.54
KMT2A Q03164 5/20 0.48
MEN1 O00255 4/20 0.48
GAA P10253 3/20 0.48
LMNA P02545 3/20 0.48
USP2 O75604 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
TP53 P04637 2/20 0.44
NPC1 O15118 1/20 0.44
KDM4E B2RXH2 3/20 0.42
TSHR P16473 1/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CSNK2A1 P68400 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
SCHEMBL7913404 0.95 MAPT (0.50) MAPTKMT2AMEN1GAALMNA
SCHEMBL7913378 0.94 MAPT (0.55) MAPTKMT2AMEN1GAALMNA
SCHEMBL7904825 0.88 MAPT (0.63) MAPTKMT2AMEN1GAALMNA
SCHEMBL7918641 0.86 MAPT (0.45) MAPTKMT2AMEN1GAALMNA
SCHEMBL7913358 0.83 THRB (0.49) MAPTKMT2AMEN1GAALMNA
SCHEMBL7904894 0.82 MAPT (0.62) MAPTKMT2AMEN1GAALMNA
SCHEMBL7915119 0.81 MAPT (0.43) MAPTKMT2AGAALMNATP53
SCHEMBL7904904 0.80 CA1 (0.50) MAPTKMT2AMEN1LMNATP53
SCHEMBL7918610 0.80 MEN1 (0.56) MAPTKMT2AMEN1GAALMNA
SCHEMBL7912149 0.80 THRB (0.50) MAPTKMT2AMEN1GAALMNA

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