SCHEMBL29052240

SCHEMBL29052240

CC(C)(C)[Si](O[C@H]1CCN(C(=O)Cl)C1)(c1ccccc1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
USP30 Q70CQ3 1/20 0.36
GPR119 Q8TDV5 1/20 0.36
RBP4 P02753 2/20 0.35
HMOX1 P09601 1/20 0.35
BACE1 P56817 1/20 0.35
GAA P10253 1/20 0.35
CHRM3 P20309 3/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM1 P11229 1/20 0.34
ACHE P22303 1/20 0.34
EPHX2 P34913 2/20 0.34
JAK2 O60674 1/20 0.34
JAK1 P23458 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
SCHEMBL29051803 1.00 MEN1 (0.36) MEN1KMT2AUSP30GPR119RBP4
SCHEMBL29051800 1.00 MEN1 (0.36) MEN1KMT2AUSP30GPR119RBP4
SCHEMBL14945259 0.92 MEN1 (0.38) MEN1KMT2AGPR119RBP4BACE1
SCHEMBL30065370 0.90 MEN1 (0.38) MEN1KMT2AUSP30GPR119RBP4
SCHEMBL30468471 0.85 GRM5 (0.43) MEN1KMT2AUSP30GPR119RBP4
SCHEMBL516800 0.84 MEN1 (0.40) MEN1KMT2AGPR119RBP4BACE1
SCHEMBL10187737 0.82 SMN1; SMN2 (0.52) MEN1KMT2AUSP30
SCHEMBL1441247 0.82 SMN1; SMN2 (0.52) MEN1KMT2AUSP30
SCHEMBL517028 0.81 RBP4 (0.38) MEN1KMT2AUSP30RBP4BACE1
SCHEMBL15032343 0.80 GPR119 (0.55) MEN1KMT2AUSP30GPR119GAA

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-116332910-A 2-aminopyrimidine derivatives as kinase inhibitors, preparation and use thereof 江苏威凯尔医药科技有限公司 2023-06-27 CN disclosed