SCHEMBL24802483

SCHEMBL24802483

Cc1cnc(O)c(CC(=O)N2CCCC2)c1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.48
HPGD P15428 4/20 0.44
ECE2 P0DPD6 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GRIN2B Q13224 3/20 0.40
ALDH1A1 P00352 2/20 0.40
TSHR P16473 2/20 0.40
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
GAA P10253 1/20 0.39
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL24802443 0.82 POLB (0.48) POLBHPGDECE2SMN1; SMN2MEN1
SCHEMBL24802437 0.72 GAA (0.35) HPGDGRIN2BGAA
SCHEMBL25795552 0.71 NOS3 (0.39) HPGDSMN1; SMN2KMT2AALDH1A1GAA
SCHEMBL17868771 0.69 KMT2A (0.58) POLBHPGDSMN1; SMN2MEN1KMT2A
SCHEMBL24804840 0.67 GAA (0.44) POLBHPGDECE2SMN1; SMN2ALDH1A1
SCHEMBL12987867 0.67 POLB (0.47) POLBHPGDECE2SMN1; SMN2MEN1
SCHEMBL30148645 0.66 POLB (0.40) POLBHPGDECE2SMN1; SMN2MEN1
SCHEMBL17572089 0.66 MEN1 (0.69) POLBHPGDSMN1; SMN2MEN1KMT2A
SCHEMBL1072706 0.66 KMT2A (0.56) POLBHPGDSMN1; SMN2MEN1KMT2A
SCHEMBL22800924 0.66 MEN1 (0.50) POLBSMN1; SMN2MEN1KMT2AALDH1A1

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
WO-2022268209-A1 DERIVATIVE HAVING PYRIMIDINE-FUSED CYCLIC STRUCTURE, AND USE THEREOF 四川汇宇制药股份有限公司 2022-12-29 WO disclosed