SCHEMBL2715768

SCHEMBL2715768

CC(C)(C)OC(=O)N1CCN(c2ncccc2O)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.57
GPR119 Q8TDV5 4/20 0.53
SMARCA2 P51531 1/20 0.53
SMARCA4 P51532 1/20 0.53
PBRM1 Q86U86 1/20 0.53
TRPA1 O75762 3/20 0.51
TRPV1 Q8NER1 2/20 0.51
KIT P10721 2/20 0.51
GBA1 P04062 1/20 0.51
CKS1B P61024 1/20 0.50
SKP1 P63208 1/20 0.50
SKP2 Q13309 1/20 0.50
DTYMK P23919 1/20 0.49
GRIA1 P42261 1/20 0.48
ACHE P22303 1/20 0.48
PDE10A Q9Y233 1/20 0.48
GAA P10253 1/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL31046329 1.00 POLB (0.57) POLBGPR119SMARCA2SMARCA4PBRM1
SCHEMBL3436722 0.87 POLB (0.57) POLBGPR119TRPA1TRPV1KIT
SCHEMBL29741422 0.86 POLB (0.56) POLBGPR119SMARCA2SMARCA4PBRM1
SCHEMBL30591901 0.86 POLB (0.56) POLBGPR119TRPA1TRPV1KIT
SCHEMBL761090 0.86 POLB (0.56) POLBGPR119TRPA1TRPV1KIT
SCHEMBL11356927 0.86 HRH3 (0.56) POLBGPR119TRPA1TRPV1KIT
SCHEMBL2421627 0.86 TRPA1 (0.68) POLBGPR119TRPA1TRPV1
SCHEMBL1433068 0.86 POLB (0.56) POLBGPR119TRPA1TRPV1KIT
SCHEMBL3335222 0.86 POLB (0.56) POLBGPR119SMARCA2SMARCA4PBRM1
SCHEMBL2560776 0.86 POLB (0.56) POLBGPR119TRPA1TRPV1KIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024151833-A1 SPIRO DERIVATIVES AS M4 ACTIVATORS/MODULATORS AND USES THEREOF CEREVEL THERAPEUTICS, LLC (US) 2024-07-18 WO disclosed
WO-2024151833-A1 SPIRO DERIVATIVES AS M4 ACTIVATORS/MODULATORS AND USES THEREOF CEREVEL THERAPEUTICS, LLC (US) 2024-07-18 WO disclosed
WO-2012061337-A1 FGFR2 MODULATORS EXELIXIS, INC. (US) 2012-05-10 WO disclosed
WO-2012061337-A1 FGFR2 MODULATORS EXELIXIS, INC. (US) 2012-05-10 WO disclosed