SCHEMBL4962387

SCHEMBL4962387

O=C(NC1CCCCC1)Oc1ccc2cccnc2c1.O=C(NCC1CCCCC1)Oc1ccc2cccnc2c1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.58
EPHX1 P07099 1/20 0.58
RAB9A P51151 3/20 0.48
ALDH1A1 P00352 2/20 0.48
NPC1 O15118 1/20 0.48
MAPT P10636 1/20 0.48
NR2F2 P24468 1/20 0.48
MAPK1 P28482 1/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL4963944 0.94 P2RX7 (0.47) FAAHEPHX1RAB9AALDH1A1NPC1
SCHEMBL4962238 0.91 FAAH (0.70) FAAHEPHX1RAB9AALDH1A1
SCHEMBL5517974 0.91 FAAH (0.70) FAAHEPHX1RAB9AALDH1A1
SCHEMBL4964213 0.85 ALDH1A1 (0.59) FAAHEPHX1RAB9AALDH1A1NPC1
SCHEMBL4962789 0.82 FAAH (0.70) FAAHEPHX1RAB9AALDH1A1NPC1
SCHEMBL14470481 0.79 EPHX1 (0.65) FAAHEPHX1ALDH1A1NPC1SMN1; SMN2
SCHEMBL1690685 0.75 FAAH (1.00) FAAHEPHX1RAB9AALDH1A1
SCHEMBL4963922 0.73 PRMT3 (0.50) FAAHEPHX1NPC1
SCHEMBL4965304 0.73 EPHX1 (0.70) EPHX1NPC1MAPT
SCHEMBL5520154 0.72 RAB9A (0.45) FAAHRAB9AALDH1A1NPC1HTT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1969051-A2 INHIBITORS OF FATTY ACID AMIDE HYDROLASE N.V. Organon (NL) 2008-09-17 EP disclosed
WO-2008024139-A2 INHIBITORS OF FATTY ACID AMIDE HYDROLASE N.V. ORGANON (NL) 2008-02-28 WO disclosed
WO-2007079180-A2 INHIBITORS OF FATTY ACID AMIDE HYDROLASE N.V. ORGANON (NL) 2007-07-12 WO disclosed