SCHEMBL26856484

SCHEMBL26856484

Cc1cccnc1C(=O)NC[C@@H]1CCOC1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.52
CNR2 P34972 3/20 0.52
NAMPT P43490 8/20 0.50
CYP2C9 P11712 1/20 0.48
ADORA2B P29275 1/20 0.47
GRM4 Q14833 2/20 0.47
GABRA5 P31644 1/20 0.45
GSK3B P49841 3/20 0.45
KCNH2 Q12809 3/20 0.45

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
SCHEMBL26898605 0.85 CNR2 (0.49) CNR1CNR2NAMPTCYP2C9ADORA2B
SCHEMBL27021658 0.85 CNR2 (0.49) CNR1CNR2NAMPTCYP2C9ADORA2B
SCHEMBL4253583 0.81 CNR1 (0.60) CNR1CNR2NAMPTCYP2C9GRM4
SCHEMBL13161996 0.80 NAMPT (0.50) NAMPTGABRA5
SCHEMBL26856708 0.79 MAPT (0.66)
SCHEMBL28503120 0.78 P2RX7 (0.47) CNR2NAMPT
SCHEMBL5422989 0.77 NAMPT (0.59) NAMPTGABRA5
SCHEMBL13162011 0.76 NAMPT (0.52) CNR2NAMPTADORA2BGABRA5
SCHEMBL13161990 0.76 GRM5 (0.54) GRM4
SCHEMBL26856716 0.74 CNR2 (0.43) CNR1CNR2CYP2C9ADORA2B

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-2023212693-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE PETRA PHARMA CORPORATION (US) 2023-11-02 WO disclosed