SCHEMBL31483076

SCHEMBL31483076

Cn1cc(CCCNC(N)=O)cn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.44
ALDH1A1 P00352 3/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
HTT P42858 1/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 1/20 0.42
JAK2 O60674 3/20 0.41
JAK3 P52333 3/20 0.41
JAK1 P23458 2/20 0.41
GAA P10253 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
OPRM1 P35372 1/20 0.40
OPRK1 P41145 1/20 0.40
MAPK1 P28482 2/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
TSHR P16473 1/20 0.38
HAT1 O14929 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
SCHEMBL30600853 0.91 NPC1 (0.46) SMN1; SMN2ALDH1A1L3MBTL1HTTMEN1
SCHEMBL9776 0.81 MEN1 (0.43) SMN1; SMN2ALDH1A1L3MBTL1HTTMEN1
SCHEMBL21246174 0.81 ALDH1A1 (0.57) SMN1; SMN2ALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL4662749 0.76 MEN1 (0.47) SMN1; SMN2ALDH1A1L3MBTL1HTTMEN1
SCHEMBL28856739 0.74 RXRA (0.47) SMN1; SMN2ALDH1A1L3MBTL1HTTMEN1
SCHEMBL23932729 0.74 MEN1 (0.46) SMN1; SMN2ALDH1A1L3MBTL1HTTMEN1
SCHEMBL23610743 0.74 NPC1 (0.43) SMN1; SMN2ALDH1A1L3MBTL1HTTMEN1
SCHEMBL23610744 0.74 NPC1 (0.43) SMN1; SMN2ALDH1A1L3MBTL1HTTMEN1
SCHEMBL3327111 0.73 JAK2 (0.40) SMN1; SMN2ALDH1A1L3MBTL1HTTMEN1
SCHEMBL31483066 0.73 CYP2A6 (0.40) SMN1; SMN2ALDH1A1L3MBTL1HTT

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-119841829-A Compounds for the treatment of PI3K gamma mediated diseases and uses thereof 中国科学院合肥物质科学研究院 2025-04-18 CN disclosed