SCHEMBL30848770

SCHEMBL30848770

CC1CN(C(=O)OC(C)(C)C)CC=C1O[Si](C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
RECQL P46063 1/20 0.37
KDM4E B2RXH2 2/20 0.37
GPR119 Q8TDV5 2/20 0.37
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37
NR1H2 P55055 2/20 0.37
GRM5 P41594 2/20 0.37
USP30 Q70CQ3 1/20 0.35
GRM1 Q13255 1/20 0.35
PDK4 Q16654 1/20 0.35

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
SCHEMBL30164510 0.88 USP2 (0.35) USP2SMN1; SMN2GPR119GRM5USP30
SCHEMBL15785128 0.80 GPR119 (0.39) GPR119NR1H2USP30PDK4
SCHEMBL21135638 0.79 NR1H2 (0.41) USP2SMN1; SMN2KDM4EGPR119MAPT
SCHEMBL19759343 0.79 NR1H2 (0.41) USP2SMN1; SMN2KDM4EGPR119MAPT
SCHEMBL31214052 0.78 USP2 (0.36) USP2SMN1; SMN2KDM4EGPR119MAPT
SCHEMBL16052667 0.77 USP30 (0.40) USP2SMN1; SMN2KDM4EGPR119MAPT
SCHEMBL16052666 0.77 USP30 (0.40) USP2SMN1; SMN2KDM4EGPR119MAPT
SCHEMBL10181219 0.77 RORC (0.38) KDM4EGPR119USP30PDK4
SCHEMBL31363968 0.75 NPSR1 (0.53) SMN1; SMN2KDM4EMAPTGRM5PDK4
SCHEMBL25047623 0.75 PDK4 (0.39) USP2SMN1; SMN2KDM4EGPR119MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117916232-A Heterocyclic EGFR inhibitors for the treatment of cancer 缆图药品公司 2024-04-19 CN disclosed
CN-117858872-A Heterocyclic EGFR inhibitors for the treatment of cancer 缆图药品公司 2024-04-09 CN disclosed