SCHEMBL29317443

SCHEMBL29317443

CCCCC(=O)c1ccc(C2CC2)nc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 7/20 0.49
HTR7 P34969 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.41
STS P08842 1/20 0.40
IDO1 P14902 1/20 0.40
PDE4A P27815 2/20 0.40
PDE4B Q07343 2/20 0.40
PDE4C Q08493 2/20 0.40
PDE4D Q08499 2/20 0.40
HRH2 P25021 1/20 0.40
HRH1 P35367 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NPC1 O15118 1/20 0.40

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
SCHEMBL10355659 0.90 HSD17B3 (0.42) HSD17B3HTR7HRH2HRH1MEN1
SCHEMBL10355660 0.90 HSD17B3 (0.42) HSD17B3HTR7HRH2HRH1MEN1
SCHEMBL18397231 0.78 GSK3B (0.43) L3MBTL1MEN1KMT2A
SCHEMBL29539684 0.78 GSK3B (0.43) L3MBTL1MEN1KMT2A
SCHEMBL29539403 0.76 MEN1 (0.43) L3MBTL1IDO1MEN1KMT2A
SCHEMBL18397093 0.76 MEN1 (0.43) L3MBTL1IDO1MEN1KMT2A
SCHEMBL21207698 0.75 IDO1 (0.53) L3MBTL1IDO1KMT2ANPC1
SCHEMBL20372049 0.75 HSD17B3 (0.54) HSD17B3HTR7L3MBTL1MEN1KMT2A
SCHEMBL25331810 0.75 CA12 (0.47) L3MBTL1MEN1KMT2ANPC1
SCHEMBL17663686 0.75 IDO1 (0.44) L3MBTL1IDO1MEN1KMT2A

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
EP-3795563-B1 INDOLINE ANALOGS AND USES THEREOF ONCTERNAL THERAPEUTICS INC (US) 2024-07-17 EP disclosed