SCHEMBL5221652

SCHEMBL5221652

CN(CC1OCCO1)C(=O)c1cc(Cl)ccc1NC(=O)c1cccc2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.55
CNR2 P34972 2/20 0.55
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
RAB9A P51151 1/20 0.53
ALDH1A1 P00352 5/20 0.46
NPC1 O15118 1/20 0.46
TP53 P04637 1/20 0.45
GFER P55789 1/20 0.45
SERPINE1 P05121 1/20 0.43
POLB P06746 2/20 0.41
G6PD P11413 1/20 0.41
KDM4E B2RXH2 2/20 0.41
F2 P00734 1/20 0.41
F10 P00742 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
BACE1 P56817 1/20 0.40

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
SCHEMBL5259884 0.82 CNR1 (0.73) CNR1CNR2MEN1KMT2ARAB9A
SCHEMBL4190787 0.80 CNR1 (0.65) CNR1CNR2MEN1KMT2ARAB9A
SCHEMBL1308410 0.75 GFER (0.76) CNR1CNR2MEN1KMT2ARAB9A
SCHEMBL5226089 0.75 CNR1 (0.63) CNR1CNR2MEN1KMT2ARAB9A
SCHEMBL4200958 0.74 CNR2 (0.62) CNR1CNR2MEN1KMT2ARAB9A
SCHEMBL4194303 0.74 CNR1 (0.90) CNR1CNR2MEN1KMT2ARAB9A
SCHEMBL5258216 0.72 CNR1 (0.67) CNR1CNR2MEN1KMT2ARAB9A
SCHEMBL4195045 0.72 MEN1 (0.57) CNR1CNR2MEN1KMT2ARAB9A
SCHEMBL4199317 0.72 CNR1 (0.73) CNR1CNR2MEN1KMT2ARAB9A
SCHEMBL4190780 0.71 CNR1 (1.00) CNR1CNR2MEN1KMT2ARAB9A

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
EP-1756044-A1 THERAPEUTIC COMPOUNDS AstraZeneca AB (SE) 2007-02-28 EP claimed
WO-2005115972-A1 THERAPEUTIC COMPOUNDS ASTRAZENECA AB (SE) 2005-12-08 WO claimed
EP-1756044-A1 THERAPEUTIC COMPOUNDS AstraZeneca AB (SE) 2007-02-28 EP disclosed
WO-2005115972-A1 THERAPEUTIC COMPOUNDS ASTRAZENECA AB (SE) 2005-12-08 WO disclosed