SCHEMBL4192268

SCHEMBL4192268

O=C(Nc1ccc(Cl)cc1C(=O)N1CCCC(O)C1)c1cccc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.58
CNR2 P34972 1/20 0.58
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
RAB9A P51151 1/20 0.53
ALDH1A1 P00352 3/20 0.51
NPSR1 Q6W5P4 1/20 0.51
LMNA P02545 1/20 0.47
GFER P55789 1/20 0.45
DRD4 P21917 2/20 0.43
SERPINE1 P05121 1/20 0.43
NPC1 O15118 1/20 0.42
BACE1 P56817 1/20 0.42
PDE2A O00408 1/20 0.41

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
SCHEMBL4194283 0.88 CNR1 (0.62) CNR1CNR2KMT2AMEN1RAB9A
SCHEMBL4186581 0.87 CNR1 (0.62) CNR1CNR2KMT2AMEN1RAB9A
SCHEMBL5223032 0.81 CNR1 (0.60) CNR1CNR2KMT2AMEN1RAB9A
SCHEMBL5226149 0.78 MEN1 (0.55) CNR1CNR2KMT2AMEN1RAB9A
SCHEMBL4200262 0.77 MEN1 (0.56) CNR1CNR2KMT2AMEN1RAB9A
SCHEMBL4204512 0.76 HTT (0.55) CNR1CNR2KMT2AMEN1RAB9A
SCHEMBL4199317 0.76 CNR1 (0.73) CNR1CNR2KMT2AMEN1RAB9A
SCHEMBL4197464 0.75 CNR1 (0.61) CNR1CNR2KMT2AMEN1RAB9A
SCHEMBL1308410 0.75 GFER (0.76) CNR1CNR2KMT2AMEN1RAB9A
SCHEMBL4194303 0.74 CNR1 (0.90) CNR1CNR2KMT2AMEN1RAB9A

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