SCHEMBL24739167

SCHEMBL24739167

CC(C)(C)OC(=O)N1C[C@H](OC(C)(C)C)C[C@H]1C=O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 1/20 0.40
▸ CHRM2 P08172 1/20 0.40
▸ CHRM1 P11229 1/20 0.40
▸ CHRM3 P20309 1/20 0.40
▸ JAK2 O60674 1/20 0.36
▸ JAK1 P23458 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ HSD11B1 P28845 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ TSHR P16473 1/20 0.33

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
SCHEMBL8262943 0.88 NR1H2 (0.40) NR1H2CHRM2CHRM1CHRM3ALDH1A1
SCHEMBL14371725 0.88 NR1H2 (0.40) NR1H2CHRM2CHRM1CHRM3ALDH1A1
SCHEMBL15632175 0.88 NR1H2 (0.40) NR1H2CHRM2CHRM1CHRM3ALDH1A1
SCHEMBL30680499 0.88 NR1H2 (0.40) NR1H2CHRM2CHRM1CHRM3ALDH1A1
SCHEMBL16857486 0.88 NR1H2 (0.40) NR1H2CHRM2CHRM1CHRM3ALDH1A1
SCHEMBL30680515 0.88 NR1H2 (0.40) NR1H2CHRM2CHRM1CHRM3ALDH1A1
SCHEMBL15632464 0.88 NR1H2 (0.40) NR1H2CHRM2CHRM1CHRM3ALDH1A1
SCHEMBL14155394 0.84 MMP2 (0.34) —
SCHEMBL7707939 0.83 CHRM2 (0.39) NR1H2CHRM2CHRM1CHRM3HSD11B1
SCHEMBL7712028 0.83 CHRM2 (0.39) NR1H2CHRM2CHRM1CHRM3HSD11B1

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
WO-2022253101-A1 PYRIDAZINONE COMPOUND AS PARP7 INHIBITOR 上海优理惠生医药有限公司 2022-12-08 — — WO disclosed
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