SCHEMBL4496319

SCHEMBL4496319

CN(C)C=CC(=O)c1oc2ccc(Br)cc2c1N

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.54
SMN1; SMN2 Q16637 5/20 0.54
NPC1 O15118 5/20 0.54
MAPT P10636 3/20 0.54
ADORA2A P29274 1/20 0.54
CASP1 P29466 1/20 0.54
KDM4E B2RXH2 6/20 0.52
HSD17B10 Q99714 4/20 0.52
TP53 P04637 2/20 0.52
LMNA P02545 2/20 0.48
RECQL P46063 1/20 0.48
AHR P35869 1/20 0.41
ALDH1A1 P00352 5/20 0.41
HPGD P15428 3/20 0.41
CASP6 P55212 1/20 0.41
KCNH2 Q12809 1/20 0.41
TSHR P16473 2/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39

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
SCHEMBL4496315 0.85 RAB9A (0.46) RAB9ASMN1; SMN2NPC1MAPTADORA2A
SCHEMBL4505174 0.81 MAPT (0.55) RAB9ASMN1; SMN2NPC1MAPTKDM4E
SCHEMBL4505169 0.81 MAPT (0.55) RAB9ASMN1; SMN2NPC1MAPTKDM4E
SCHEMBL15780625 0.79 MAPT (0.63) RAB9ASMN1; SMN2NPC1MAPTADORA2A
SCHEMBL15766143 0.79 MAPT (0.63) RAB9ASMN1; SMN2NPC1MAPTADORA2A
SCHEMBL4504540 0.79 MAPT (0.63) RAB9ASMN1; SMN2NPC1MAPTADORA2A
SCHEMBL13600990 0.78 MAPT (0.45) RAB9ASMN1; SMN2NPC1MAPTKDM4E
SCHEMBL4504641 0.78 SMN1; SMN2 (0.65) RAB9ASMN1; SMN2NPC1MAPTADORA2A
SCHEMBL1850280 0.76 KDM4E (0.67) RAB9ASMN1; SMN2NPC1MAPTADORA2A
SCHEMBL4496632 0.74 ALDH1A1 (0.48) RAB9ASMN1; SMN2NPC1MAPTADORA2A

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
US-7638540-B2 Benzofuran compound and medicinal composition containing the same THE NEW INDUSTRY RESEARCH ORGANIZATION (JP) 2009-12-29 US disclosed
US-20060194851-A1 Benzofuran compound and medicinal composition containing the same NEW INDUSTRY RESEARCH ORGANIZATION, THE (JP) 2006-08-31 US disclosed
EP-1627873-A1 BENZOFURAN COMPOUND AND MEDICINAL COMPOSITION CONTAINING THE SAME The New Industry Research Organization (JP) 2006-02-22 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060194851-A1 Benzofuran compound and medicinal composition containing the same LTB4R2, LTC4S, LTB4R RAB9A 4698/4885SMN1; SMN2 2975/4885NPC1 1377/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.