Benzo[D]Isoxazole

Benzo[D]Isoxazole

SCHEMBL3645456

O=C(O)N1CCN(Cc2cccc(Oc3ccc(F)cc3)c2)CC1.c1ccc2oncc2c1

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FAAH O00519 15/20 0.56
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
GAA P10253 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
MGLL Q99685 7/20 0.50
TRPV6 Q9H1D0 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
Benzo[D]Isoxazole SCHEMBL3643818 0.92 FAAH (0.56) FAAHKDM4EALDH1A1LMNAGAA
Benzo[D]Isoxazole SCHEMBL3642872 0.91 FAAH (0.61) FAAH
Benzo[D]Isoxazole SCHEMBL3642701 0.89 KDM4E (0.53) FAAHKDM4EALDH1A1LMNAGAA
Benzo[D]Isoxazole SCHEMBL3638799 0.89 KDM4E (0.51) FAAHKDM4EALDH1A1LMNAGAA
Benzo[D]Isoxazole SCHEMBL3636254 0.86 ALDH1A1 (0.49) FAAHKDM4EALDH1A1LMNAGAA
SCHEMBL3644401 0.80 KDM4E (0.79) FAAHKDM4EALDH1A1LMNAGAA
SCHEMBL4103135 0.76 FAAH (0.84) FAAH
SCHEMBL3355088 0.75 FAAH (0.74) FAAHKDM4EALDH1A1LMNAGAA
SCHEMBL1759013 0.74 FAAH (0.66) FAAHKDM4EALDH1A1LMNAGAA
SCHEMBL20570424 0.73 TRPV6 (0.70) FAAHKDM4EALDH1A1LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2164493-A2 HETEROARYL-SUBSTITUTED UREA MODULATORS OF FATTY ACID AMIDE HYDROLASE Janssen Pharmaceutica, N.V. (BE) 2010-03-24 EP claimed
WO-2008153752-A2 HETEROARYL-SUBSTITUTED UREA MODULATORS OF FATTY ACID AMIDE HYDROLASE JANSSEN PHARMACEUTICA N.V. (BE) 2008-12-18 WO claimed