SCHEMBL13601000

SCHEMBL13601000

C/C=C/C(=O)Nc1c(Cl)oc2c(OC)cccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.40
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
LMNA P02545 4/20 0.39
ALDH1A1 P00352 4/20 0.39
NPC1 O15118 3/20 0.39
KDM4E B2RXH2 2/20 0.39
RAB9A P51151 2/20 0.39
MMP1 P03956 2/20 0.39
MMP2 P08253 2/20 0.39
MMP9 P14780 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LTB4R Q15722 1/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
HPGD P15428 2/20 0.38
ABCC9 O60706 1/20 0.38
ABCC8 Q09428 1/20 0.38
KCNJ11 Q14654 1/20 0.38
KCNJ8 Q15842 1/20 0.38

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
SCHEMBL4495083 0.86 MMP1 (0.56) MAOALMNAALDH1A1NPC1RAB9A
SCHEMBL4495075 0.86 MMP1 (0.56) MAOALMNAALDH1A1NPC1RAB9A
SCHEMBL13600996 0.84 SMN1; SMN2 (0.42) MAOAMTNR1AMTNR1BLMNAALDH1A1
SCHEMBL4503457 0.71 MMP1 (0.55) MAOALMNANPC1RAB9AMMP1
SCHEMBL4503448 0.71 MMP1 (0.55) MAOALMNANPC1RAB9AMMP1
SCHEMBL4502463 0.70 TSHR (0.48) MAOALMNAALDH1A1NPC1KDM4E
SCHEMBL4493327 0.70 ALDH1A1 (0.50) MAOALMNAALDH1A1NPC1KDM4E
SCHEMBL4493330 0.67 MAOA (0.47) MAOALMNAALDH1A1NPC1KDM4E
SCHEMBL4507435 0.66 NPSR1 (0.47) MAOALMNAALDH1A1NPC1KDM4E
SCHEMBL20514054 0.66 SMN1; SMN2 (0.69) LMNAALDH1A1KDM4EMMP1MMP2

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
US-7638540-B2 Benzofuran compound and medicinal composition containing the same THE NEW INDUSTRY RESEARCH ORGANIZATION (JP) 2009-12-29 US disclosed