SCHEMBL30306362

SCHEMBL30306362

COc1ccc(Cc2nnc3[nH]c(=O)c4ccccc4n23)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
KMT2A Q03164 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.46
P2RX4 Q99571 1/20 0.44
MEN1 O00255 1/20 0.41
MET P08581 1/20 0.41
PARP1 P09874 2/20 0.40
CHRM1 P11229 1/20 0.40
NPC1 O15118 1/20 0.40
TNKS O95271 1/20 0.40
GUSB P08236 1/20 0.40
CASP3 P42574 1/20 0.40
RAB9A P51151 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
TNKS2 Q9H2K2 1/20 0.40
TP53 P04637 2/20 0.39
HSP90AB1 P08238 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL29995067 0.87 DNM1 (0.43) ALDH1A1KMT2ASMN1; SMN2P2RX4MEN1
SCHEMBL7415595 0.84 PLK1 (0.43) ALDH1A1KMT2ASMN1; SMN2MEN1MET
SCHEMBL20100768 0.79 RPA1 (0.43) ALDH1A1KMT2ASMN1; SMN2MEN1PARP1
SCHEMBL30961044 0.72 NPC1 (0.39) ALDH1A1KMT2AMEN1PARP1NPC1
SCHEMBL15083751 0.71 PARP1 (0.47) ALDH1A1KMT2ASMN1; SMN2MEN1PARP1
SCHEMBL29994664 0.71 ALDH1A1 (0.46) ALDH1A1KMT2AMEN1PARP1TNKS
SCHEMBL31189203 0.70 P2RX4 (0.68) ALDH1A1KMT2ASMN1; SMN2P2RX4MEN1
SCHEMBL8348004 0.70 P2RX4 (0.68) ALDH1A1KMT2ASMN1; SMN2P2RX4MEN1
SCHEMBL17297888 0.68 PARP1 (0.41) ALDH1A1KMT2AMEN1PARP1
SCHEMBL9917406 0.67 P2RX4 (0.59) KMT2ASMN1; SMN2P2RX4MEN1CHRM1

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
CN-115197225-B Five-membered heterocyclic quinazolinone compound and preparation method thereof 贵州大学 2023-04-11 CN disclosed