SCHEMBL29280770

SCHEMBL29280770

COCC1C=C(B2OC(C)(C)C(C)(C)O2)CN1C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.36
AAK1 Q2M2I8 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
BUB1 O43683 1/20 0.31
DGAT1 O75907 1/20 0.30
PTPN1 P18031 1/20 0.30

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
SCHEMBL23991558 1.00 USP30 (0.36) USP30AAK1MEN1KMT2ABUB1
SCHEMBL27174548 0.84 MAPK1 (0.33)
SCHEMBL27174551 0.84 MAPK1 (0.33)
SCHEMBL29524125 0.83 SMYD2 (0.35) USP30MEN1KMT2A
SCHEMBL29035344 0.83 SMYD2 (0.35) USP30MEN1KMT2A
SCHEMBL30301912 0.83 SMYD2 (0.35) USP30MEN1KMT2A
SCHEMBL19078451 0.82 USP30 (0.38) USP30AAK1MEN1KMT2ABUB1
SCHEMBL16339902 0.81 USP30 (0.40) USP30AAK1BUB1DGAT1PTPN1
SCHEMBL28648680 0.81 USP30 (0.40) USP30AAK1BUB1DGAT1PTPN1
SCHEMBL16339903 0.81 USP30 (0.40) USP30AAK1BUB1DGAT1PTPN1

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-117813298-A Imidazole indazole compounds as JAK inhibitors 施万生物制药研发IP有限责任公司 2024-04-02 CN disclosed