SCHEMBL25883229

SCHEMBL25883229

CN1C[C@@H]2C(NC(=O)c3cccc(-c4cn5ccccc5n4)c3)[C@@H]2C1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.58
SMN1; SMN2 Q16637 7/20 0.58
RAB9A P51151 5/20 0.58
LMNA P02545 5/20 0.58
POLB P06746 3/20 0.58
GFER P55789 2/20 0.58
ALDH1A1 P00352 11/20 0.56
MAPT P10636 3/20 0.56
KMT2A Q03164 3/20 0.56
HPGD P15428 6/20 0.53
NPC1 O15118 2/20 0.52
TP53 P04637 1/20 0.52
MAPK1 P28482 2/20 0.52
HSD17B10 Q99714 2/20 0.48
GAA P10253 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MEN1 O00255 2/20 0.47
CASP3 P42574 1/20 0.47
SENP8 Q96LD8 1/20 0.47

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
SCHEMBL25878144 0.89 KDM4E (0.57) KDM4ESMN1; SMN2RAB9ALMNAPOLB
SCHEMBL25883304 0.86 KDM4E (0.59) KDM4ESMN1; SMN2RAB9ALMNAPOLB
SCHEMBL25883242 0.86 KDM4E (0.59) KDM4ESMN1; SMN2RAB9ALMNAPOLB
SCHEMBL25878621 0.84 RAB9A (0.57) KDM4ESMN1; SMN2RAB9ALMNAPOLB
SCHEMBL25315909 0.80 KDM4E (0.47) KDM4ESMN1; SMN2RAB9ALMNAPOLB
SCHEMBL29484599 0.80 KDM4E (0.47) KDM4ESMN1; SMN2RAB9ALMNAPOLB
SCHEMBL27180290 0.80 KDM4E (0.47) KDM4ESMN1; SMN2RAB9ALMNAPOLB
SCHEMBL25311688 0.80 KDM4E (0.54) KDM4ESMN1; SMN2RAB9ALMNAPOLB
SCHEMBL25311896 0.80 KDM4E (0.47) KDM4ESMN1; SMN2RAB9ALMNAPOLB
SCHEMBL25883305 0.80 KDM4E (0.47) KDM4ESMN1; SMN2RAB9ALMNAPOLB

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-4215526-A1 CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF Shanghai Pharmaceuticals Holding Co., Ltd. (CN) 2023-07-26 EP disclosed