SCHEMBL7918667

SCHEMBL7918667

Cc1ccc(C)c(Nc2nnc(-c3ccc(C(=O)O)cc3)c3ccccc23)c1

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.68
THRB P10828 2/20 0.62
MAPT P10636 2/20 0.57
GAA P10253 1/20 0.57
MAPK1 P28482 1/20 0.53
GPR174 Q9BXC1 2/20 0.52
TP53 P04637 3/20 0.50
NPSR1 Q6W5P4 1/20 0.50
ENPP3 O14638 1/20 0.49
ALDH1A1 P00352 1/20 0.49
KLK7 P49862 1/20 0.48
KLK14 Q9P0G3 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
SCHEMBL7904829 0.88 THRB (0.66) KDRTHRBMAPTGAAMAPK1
SCHEMBL7918619 0.88 THRB (0.69) KDRTHRBMAPTGAAMAPK1
SCHEMBL7912171 0.86 KDR (0.62) KDRTHRBMAPTGAAMAPK1
SCHEMBL7918511 0.86 MAPT (0.65) KDRTHRBMAPTGAAMAPK1
SCHEMBL7914872 0.83 THRB (0.64) KDRTHRBMAPTGAAMAPK1
SCHEMBL7912098 0.83 THRB (0.64) KDRTHRBMAPTGAAMAPK1
SCHEMBL7913339 0.81 THRB (0.62) KDRTHRBMAPTGAAMAPK1
SCHEMBL7912029 0.79 NPSR1 (0.72) KDRTHRBGAANPSR1ENPP3
SCHEMBL7913372 0.78 KDR (0.72) KDRTHRBMAPTGAAGPR174
SCHEMBL7918550 0.78 THRB (0.58) KDRTHRBMAPTGAAMAPK1

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