SCHEMBL31046207

SCHEMBL31046207

CC(C)(C)OC(=O)N1CCC(O)(c2ncc(F)cc2Br)CC1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
SYK P43405 1/20 0.41
JAK2 O60674 2/20 0.40
JAK1 P23458 2/20 0.40
ROCK2 O75116 1/20 0.38
ACACB O00763 2/20 0.38
MKNK1 Q9BUB5 1/20 0.38
PKM P14618 1/20 0.38
NAMPT P43490 1/20 0.38

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
SCHEMBL29335912 1.00 GPR119 (0.41) GPR119HDAC1HDAC2SYKJAK2
SCHEMBL31046508 0.88 GPR119 (0.41) GPR119HDAC1HDAC2JAK2JAK1
SCHEMBL29335913 0.88 GPR119 (0.41) GPR119HDAC1HDAC2JAK2JAK1
SCHEMBL9998899 0.85 GPR119 (0.41) GPR119HDAC1HDAC2SYKROCK2
SCHEMBL29560741 0.84 GPR119 (0.44) GPR119HDAC1HDAC2JAK2JAK1
SCHEMBL22866759 0.84 GPR119 (0.44) GPR119HDAC1HDAC2JAK2JAK1
SCHEMBL9998878 0.81 ACACB (0.42) GPR119SYKROCK2ACACBPKM
SCHEMBL12074307 0.81 GPR119 (0.41) GPR119HDAC1HDAC2SYKACACB
SCHEMBL15992767 0.81 GPR119 (0.41) GPR119SYKROCK2ACACBPKM
SCHEMBL30833113 0.80 PIK3CA (0.49) GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4649077-A1 SPIRO DERIVATIVES AS M4 ACTIVATORS/MODULATORS AND USES THEREOF Cerevel Therapeutics, LLC (US) 2025-11-19 EP disclosed
WO-2024151833-A1 SPIRO DERIVATIVES AS M4 ACTIVATORS/MODULATORS AND USES THEREOF CEREVEL THERAPEUTICS, LLC (US) 2024-07-18 WO disclosed