SCHEMBL28601602

SCHEMBL28601602

COc1ccc(NC(=O)NN)cc1.O=C1CC(c2ccc(Br)cc2)Nc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FPR1 P21462 2/20 0.48
ABCB1 P08183 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TP53 P04637 1/20 0.42
FPR2 P25090 1/20 0.41
RAB9A P51151 1/20 0.40
USP2 O75604 1/20 0.40
POLB P06746 1/20 0.40
TNKS2 Q9H2K2 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
SCHEMBL28919462 1.00 FPR1 (0.48) FPR1ABCB1MEN1KMT2ATP53
SCHEMBL28919461 0.92 MAOA (0.42) FPR1MEN1KMT2AFPR2RAB9A
SCHEMBL28603922 0.91 MEN1 (0.45) ABCB1MEN1KMT2ATP53FPR2
Aza-Flavanone SCHEMBL28606333 0.90 MAOA (0.45) FPR1FPR2
SCHEMBL28601605 0.89 KDR (0.39) FPR1MEN1KMT2AFPR2RAB9A
SCHEMBL28603992 0.89 KDR (0.39) FPR1MEN1KMT2AFPR2RAB9A
SCHEMBL28599108 0.88 FPR1 (0.47) FPR1MEN1KMT2AFPR2
SCHEMBL28608358 0.88 FPR1 (0.47) FPR1MEN1KMT2AFPR2
SCHEMBL28608429 0.88 MAPT (0.44) ABCB1MEN1KMT2ATP53FPR2
SCHEMBL28614837 0.87 KDR (0.40) FPR1MEN1KMT2AFPR2RAB9A

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-108558756-B 2-aryl-2, 3-dihydro-4 (1H) -quinolinone semicarbazone compound and application thereof 沈阳药科大学 2021-08-03 CN claimed
CN-108558756-B 2-aryl-2, 3-dihydro-4 (1H) -quinolinone semicarbazone compound and application thereof 沈阳药科大学 2021-08-03 CN disclosed