SCHEMBL23950733

SCHEMBL23950733

CC(C)(C)OC(=O)CC1CC(O)CCN1C(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 1/20 0.44
HSD17B10 Q99714 1/20 0.36
PREP P48147 1/20 0.36
NR1H2 P55055 1/20 0.35
ATM Q13315 2/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 1/20 0.34
KDM4E B2RXH2 1/20 0.33
PKM P14618 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
SCHEMBL24024276 1.00 CHRM2 (0.44) CHRM2CHRM1CHRM3HSD17B10PREP
SCHEMBL23926142 0.89 CHRM2 (0.38) CHRM2CHRM1CHRM3HSD17B10PREP
SCHEMBL9310931 0.85 CHRM2 (0.46) CHRM2CHRM1CHRM3HSD17B10PREP
SCHEMBL9310923 0.85 CHRM2 (0.46) CHRM2CHRM1CHRM3HSD17B10PREP
SCHEMBL19189558 0.85 CHRM2 (0.46) CHRM2CHRM1CHRM3HSD17B10PREP
SCHEMBL583949 0.85 CHRM2 (0.46) CHRM2CHRM1CHRM3HSD17B10PREP
SCHEMBL24540373 0.85 CHRM2 (0.46) CHRM2CHRM1CHRM3HSD17B10PREP
SCHEMBL9311613 0.85 CHRM2 (0.46) CHRM2CHRM1CHRM3HSD17B10PREP
SCHEMBL16042463 0.85 CHRM2 (0.46) CHRM2CHRM1CHRM3HSD17B10PREP
SCHEMBL31080064 0.85 CHRM2 (0.46) CHRM2CHRM1CHRM3HSD17B10PREP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023034290-A1 NAPHTHYRIDINE COMPOUNDS AS INHIBITORS OF KRAS INCYTE CORPORATION (US) 2023-03-09 WO disclosed
WO-2023283213-A1 TRICYCLIC COMPOUNDS AS INHIBITORS OF KRAS INCYTE CORPORATION (US) 2023-01-12 WO disclosed
WO-2021211864-A1 FUSED TRICYCLIC KRAS INHIBITORS INCYTE CORPORATION (US) 2021-10-21 WO disclosed