SCHEMBL3372121

SCHEMBL3372121

CC(C)(C)OC(=O)N1CCC(Oc2ccc(-c3ccc(-n4cnnn4)cc3)cc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.58
MAPT P10636 4/20 0.55
CHEK2 O96017 1/20 0.54
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
POLB P06746 1/20 0.52
ADRB2 P07550 1/20 0.52

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
SCHEMBL3373764 0.91 CHEK2 (0.52) GPR119MAPTCHEK2MEN1KMT2A
SCHEMBL3372317 0.88 GPR119 (0.50) GPR119MAPTCHEK2MEN1KMT2A
SCHEMBL3370707 0.86 GPR119 (0.50) GPR119CHEK2SMN1; SMN2
SCHEMBL904065 0.84 GPR119 (0.52) GPR119MAPTCHEK2MEN1KMT2A
SCHEMBL3373458 0.81 GPR119 (0.56) GPR119MAPTCHEK2SMN1; SMN2
SCHEMBL23410251 0.81 GPR119 (0.67) GPR119CHEK2
SCHEMBL4773784 0.79 GPR119 (0.64) GPR119MAPT
SCHEMBL16989407 0.79 GPR119 (0.74) GPR119
SCHEMBL15312743 0.79 GPR119 (0.50) GPR119
SCHEMBL14873170 0.79 GPR119 (0.53) GPR119MAPTMEN1KMT2ASMN1; SMN2

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
WO-2010048149-A2 HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2010-04-29 WO disclosed
WO-2010048149-A2 HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2010-04-29 WO disclosed