SCHEMBL28896246

SCHEMBL28896246

CC(C)(C)OC(=O)N1CCC(OCCO[Si](C)(C)C(C)(C)C)(C(F)(F)F)C1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACACB O00763 5/20 0.36
USP2 O75604 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SCD5 Q86SK9 1/20 0.35
CYP11B2 P19099 1/20 0.34
USP30 Q70CQ3 1/20 0.34
RORC P51449 3/20 0.33
PIK3R1 P27986 1/20 0.33
PIK3CA P42336 1/20 0.33
RECQL P46063 1/20 0.33
TACR1 P25103 1/20 0.32
GPR119 Q8TDV5 1/20 0.32

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
SCHEMBL28896800 0.91 USP2 (0.35) ACACBUSP2SMN1; SMN2RECQL
SCHEMBL28896661 0.83 CYP4F2 (0.38) ACACBUSP2SMN1; SMN2SCD5CYP11B2
SCHEMBL28896758 0.82 USP2 (0.38) ACACBUSP2SMN1; SMN2SCD5CYP11B2
SCHEMBL29211272 0.81 RORC (0.37) ACACBUSP2SMN1; SMN2SCD5CYP11B2
SCHEMBL31752520 0.80 USP2 (0.39) ACACBUSP2SMN1; SMN2SCD5CYP11B2
SCHEMBL28896357 0.78 USP2 (0.37) ACACBUSP2SMN1; SMN2SCD5CYP11B2
SCHEMBL24113337 0.76 USP2 (0.41) ACACBUSP2SMN1; SMN2SCD5CYP11B2
SCHEMBL29581801 0.76 USP2 (0.41) ACACBUSP2SMN1; SMN2SCD5CYP11B2
SCHEMBL24012213 0.76 USP2 (0.41) ACACBUSP2SMN1; SMN2SCD5CYP11B2
SCHEMBL31629602 0.75 USP2 (0.40) ACACBUSP2SMN1; SMN2RECQLTACR1

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-115403584-B 2-thio-2, 3-dihydropyrimidine-4-one derivatives, pharmaceutical compositions, preparation methods and applications thereof 长春金赛药业有限责任公司 2024-04-02 CN disclosed
CN-115403584-A 2-thio-2, 3-dihydropyrimidine-4-one derivative, pharmaceutical composition, preparation method and application thereof 长春金赛药业有限责任公司 2022-11-29 CN disclosed