SCHEMBL25522136

SCHEMBL25522136

CCCn1nccc1C(=O)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.42
FLT1 P17948 2/20 0.40
KDR P35968 2/20 0.40
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
NR3C2 P08235 1/20 0.39
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HPGD P15428 2/20 0.38
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HCAR3 P49019 1/20 0.36
HTT P42858 1/20 0.36
PIK3CD O00329 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
RECQL P46063 1/20 0.35
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL17452804 0.86 RAB9A (0.50) MAPK1FLT1KDRRAB9ANPC1
SCHEMBL25457943 0.84 MAPK1 (0.41) MAPK1FLT1KDRRAB9ANPC1
SCHEMBL17452633 0.83 MAPK1 (0.40) MAPK1FLT1KDRRAB9ANPC1
SCHEMBL25457933 0.81 MAPK1 (0.39) MAPK1FLT1KDRRAB9ANPC1
SCHEMBL25457894 0.81 MAPK1 (0.40) MAPK1FLT1KDRRAB9ANPC1
SCHEMBL14109575 0.81 MAPK1 (0.46) MAPK1FLT1KDRRAB9ANPC1
SCHEMBL25568690 0.80 FLT1 (0.39) MAPK1FLT1KDRRAB9ANPC1
SCHEMBL4327167 0.79 NR3C2 (0.47) MAPK1FLT1KDRRAB9ANPC1
SCHEMBL17452629 0.79 MAPK1 (0.38) MAPK1FLT1KDRRAB9ANPC1
SCHEMBL25568592 0.78 MAPK1 (0.36) MAPK1FLT1KDRRAB9ANPC1

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-4183783-A1 IMMUNOMODULATOR Hitgen Inc. (CN) 2023-05-24 EP disclosed