SCHEMBL29623403

SCHEMBL29623403

COc1cc(F)ccc1Nc1nc2ccc(Cl)cc2c(=O)n1-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 2/20 0.46
PIK3CG P48736 2/20 0.46
MAPT P10636 2/20 0.44
TP53 P04637 1/20 0.44
P2RX7 Q99572 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL23064701 1.00 PI4KA (0.46) PI4KAPIK3CGMAPTTP53P2RX7
SCHEMBL29623089 0.87 PI4KA (0.43) PI4KAPIK3CG
SCHEMBL29623109 0.87 TP53 (0.50) TP53
SCHEMBL23064203 0.87 TP53 (0.50) TP53
SCHEMBL23064702 0.87 PI4KA (0.43) PI4KAPIK3CG
SCHEMBL23958175 0.83 MAPT (0.45) MAPTTP53P2RX7KDM4EALDH1A1
SCHEMBL23958260 0.82 PI4KA (0.46) PI4KAPIK3CGMAPTTP53KDM4E
SCHEMBL23065108 0.82 TP53 (0.48) PI4KAPIK3CGTP53SMN1; SMN2
SCHEMBL23064704 0.82 PDE10A (0.47) MAPTTP53P2RX7SMN1; SMN2
SCHEMBL29623176 0.82 PDE10A (0.47) MAPTTP53P2RX7SMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114650986-A 2-aminoquinazolinone derivatives 住友制药株式会社 2022-06-21 CN claimed
CN-114650986-A 2-aminoquinazolinone derivatives 住友制药株式会社 2022-06-21 CN disclosed