SCHEMBL23958216

SCHEMBL23958216

Cc1cnc2nc(Nc3cccnc3)n(-c3ccccc3)c(=O)c2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX12 P18054 1/20 0.44
MDM2 Q00987 1/20 0.43
PSD A5PKW4 1/20 0.42
PIK3CA P42336 1/20 0.41
CYP1A2 P05177 1/20 0.39
POLB P06746 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MAPT P10636 3/20 0.39
RAD52 P43351 1/20 0.38
KMT2A Q03164 1/20 0.38
G6PD P11413 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 1/20 0.38
MAPK8 P45983 1/20 0.38
MAPK9 P45984 1/20 0.38
MAPK10 P53779 1/20 0.38
LOXL3 P58215 1/20 0.37
LOXL2 Q9Y4K0 1/20 0.37

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
SCHEMBL24110803 0.88 ALOX12 (0.40) ALOX12MDM2CYP1A2POLBCYP3A4
SCHEMBL23958331 0.87 LOXL3 (0.47) ALOX12MDM2MAPTRAD52KMT2A
SCHEMBL23958215 0.85 MDM2 (0.49) ALOX12MDM2PSDPOLBMAPT
SCHEMBL30103264 0.85 MDM2 (0.49) ALOX12MDM2PSDPOLBMAPT
SCHEMBL23958124 0.82 MDM2 (0.51) ALOX12MDM2PSDMAPTG6PD
SCHEMBL23958227 0.81 ALOX12 (0.46) ALOX12MDM2PSDCYP1A2CYP3A4
SCHEMBL24111020 0.81 ALOX12 (0.46) ALOX12MDM2PSDCYP1A2CYP3A4
SCHEMBL24110995 0.79 ALOX12 (0.57) ALOX12MDM2PSDMAPTRAD52
SCHEMBL24110973 0.78 ALOX12 (0.47) ALOX12MDM2PSDMAPTRAD52
SCHEMBL23958356 0.78 ALOX12 (0.48) ALOX12MDM2PSDMAPTRAD52

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
WO-2021215537-A1 2-HETEROARYLAMINOQUINAZOLINONE DERIVATIVE 大日本住友製薬株式会社 (JP) 2021-10-28 WO disclosed