SCHEMBL29945994

SCHEMBL29945994

CC(C)(C)OC(=O)N1CCC(c2ccn(OCc3ccc(F)cc3)n2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.46
TP53 P04637 1/20 0.45
POLB P06746 1/20 0.45
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
PRMT5 O14744 1/20 0.44
ALDH1A1 P00352 2/20 0.44
TRPV3 Q8NET8 1/20 0.44
LMNA P02545 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
JAK2 O60674 1/20 0.44
JAK3 P52333 1/20 0.44
PTK2 Q05397 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL29946020 0.90 MEN1 (0.48) GPR119TP53CNR1PRMT5ALDH1A1
SCHEMBL29946017 0.90 MEN1 (0.48) GPR119TP53CNR1PRMT5ALDH1A1
SCHEMBL29945795 0.87 GPR119 (0.49) GPR119PRMT5ALDH1A1JAK2JAK3
SCHEMBL29945870 0.87 SMN1; SMN2 (0.49) GPR119TP53TRPV3LMNASMN1; SMN2
SCHEMBL29945924 0.81 TRPV3 (0.44) TP53POLBCNR1CNR2ALDH1A1
SCHEMBL18418198 0.80 MGLL (0.57) GPR119TP53POLBALDH1A1LMNA
SCHEMBL29945852 0.79 GPR119 (0.53) GPR119TRPV3JAK2JAK3PTK2
SCHEMBL13590834 0.76 GPR119 (0.52) GPR119TP53POLBPRMT5MEN1
SCHEMBL29946091 0.76 KDM4E (0.50) GPR119ALDH1A1TRPV3MEN1KMT2A
SCHEMBL25731609 0.76 GPR119 (0.50) GPR119KDM4E

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
WO-2022184849-A1 GLP-1R AGONISTS, USES AND PHARMACEUTICAL COMPOSITIONS THEREOF LES LABORATOIRES SERVIER (FR) 2022-09-09 WO disclosed