SCHEMBL24829907

SCHEMBL24829907

CC(C)(C)OC(=O)N1CC(O)CC[C@H]1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.45
CHRM1 P11229 1/20 0.45
CHRM3 P20309 1/20 0.45
HSD17B10 Q99714 2/20 0.45
CYP2C19 P33261 2/20 0.43
CYP1A2 P05177 1/20 0.43
POLB P06746 1/20 0.43
CYP3A4 P08684 1/20 0.43
ATM Q13315 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
NR1H2 P55055 1/20 0.36
HPGD P15428 1/20 0.35
BTK Q06187 1/20 0.35
LMNA P02545 1/20 0.35
NPC1 O15118 1/20 0.34

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
SCHEMBL17812940 1.00 CHRM2 (0.45) CHRM2CHRM1CHRM3HSD17B10CYP2C19
SCHEMBL6998193 1.00 CHRM2 (0.45) CHRM2CHRM1CHRM3HSD17B10CYP2C19
SCHEMBL715774 1.00 CHRM2 (0.45) CHRM2CHRM1CHRM3HSD17B10CYP2C19
SCHEMBL16857497 1.00 CHRM2 (0.45) CHRM2CHRM1CHRM3HSD17B10CYP2C19
SCHEMBL19566139 0.87 CHRM2 (0.45) CHRM2CHRM1CHRM3HSD17B10CYP2C19
SCHEMBL17812928 0.87 CHRM2 (0.45) CHRM2CHRM1CHRM3HSD17B10CYP2C19
SCHEMBL16187270 0.87 CHRM2 (0.45) CHRM2CHRM1CHRM3HSD17B10CYP2C19
SCHEMBL715773 0.87 CHRM2 (0.45) CHRM2CHRM1CHRM3HSD17B10CYP2C19
SCHEMBL13066371 0.87 CHRM2 (0.45) CHRM2CHRM1CHRM3HSD17B10CYP2C19
SCHEMBL16857337 0.86 CHRM2 (0.44) CHRM2CHRM1CHRM3HSD17B10CYP2C19

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
EP-4112616-A1 RAD51 INHIBITORS Cyteir Therapeutics, Inc. (US) 2023-01-04 EP disclosed