SCHEMBL5859017

SCHEMBL5859017

CCOC(=O)CCCN1CC[N]CC1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.46
RAB9A P51151 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 2/20 0.40
HTR4 Q13639 1/20 0.39
TNF P01375 11/20 0.39
NR1I2 O75469 1/20 0.38
PGR P06401 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
PTGS2 P35354 1/20 0.38
PDE4D Q08499 1/20 0.38
GAA P10253 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
SCHEMBL1379668 0.90 ALDH1A1 (0.43) CYP1A2RAB9AL3MBTL1LMNAPOLB
SCHEMBL11861074 0.88 CYP1A2 (0.53) CYP1A2RAB9AL3MBTL1LMNAPOLB
SCHEMBL7509641 0.87 ALDH1A1 (0.45) CYP1A2L3MBTL1LMNAALDH1A1PDE4D
SCHEMBL1855324 0.84 CYP1A2 (0.53) CYP1A2RAB9AL3MBTL1LMNAPOLB
SCHEMBL10084759 0.84 CYP1A2 (0.50) CYP1A2RAB9AL3MBTL1LMNAPOLB
SCHEMBL6052421 0.83 TSHR (0.48) CYP1A2LMNATSHRALDH1A1
SCHEMBL1127701 0.83 PAOX (0.51) CYP1A2RAB9AL3MBTL1LMNAPOLB
SCHEMBL856060 0.83 CYP1A2 (0.56) CYP1A2RAB9AL3MBTL1LMNAPOLB
SCHEMBL1863035 0.83 CYP1A2 (0.56) CYP1A2RAB9AL3MBTL1LMNAPOLB
SCHEMBL7515394 0.81 DGKA (0.49) L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7112594-B2 Fused bicyclic amide compounds and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2006-09-26 US disclosed
EP-1176140-B1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF MITSUBISHI PHARMA CORP (JP) 2004-12-29 EP disclosed
US-20030203909-A1 Fused bicyclic amide compounds and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2003-10-30 US disclosed
EP-1310488-A1 FUSED BICYCLIC AMIDE COMPOUNDS AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2003-05-14 EP disclosed
EP-1176140-A1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2002-01-30 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-20030203909-A1 Fused bicyclic amide compounds and medicinal use thereof BET1, NFATC1, ARG1 CYP1A2 1060/4885RAB9A 3542/4885L3MBTL1 1711/4885

“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.