SCHEMBL8256145

SCHEMBL8256145

O=C(c1ccccc1-c1ccccc1C(=O)N1CCNCC1)N1CCNCC1

nearest known ligand 0.70

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.70
SIGMAR1 Q99720 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.58
TSHR P16473 2/20 0.57
RECQL P46063 1/20 0.57
HRH4 Q9H3N8 1/20 0.50
HRH3 Q9Y5N1 1/20 0.50
POLB P06746 2/20 0.49
KDM4E B2RXH2 1/20 0.49
HSP90AA1 P07900 1/20 0.49
ABCC1 P33527 1/20 0.48
MEN1 O00255 1/20 0.47
USP2 O75604 1/20 0.47
ALDH1A1 P00352 1/20 0.47
KMT2A Q03164 1/20 0.47
LMNA P02545 1/20 0.47
SLC6A7 Q99884 1/20 0.47

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
SCHEMBL8253848 0.90 RXFP1 (0.77) RXFP1SIGMAR1L3MBTL1TSHRHRH4
SCHEMBL32667651 0.85 RXFP1 (0.64) RXFP1SIGMAR1TSHRRECQLHRH4
SCHEMBL22192837 0.85 RXFP1 (0.64) RXFP1SIGMAR1TSHRRECQLHRH4
SCHEMBL30417397 0.84 RXFP1 (0.68) RXFP1SIGMAR1TSHRHRH4HRH3
SCHEMBL16026597 0.84 RXFP1 (0.68) RXFP1SIGMAR1L3MBTL1TSHRHRH4
SCHEMBL12522808 0.84 RXFP1 (0.68) RXFP1SIGMAR1TSHRHRH4HRH3
SCHEMBL16298360 0.83 POLB (0.56) RXFP1SIGMAR1L3MBTL1POLBKDM4E
SCHEMBL5180736 0.82 HTT (0.70) RXFP1SIGMAR1HRH4ALDH1A1KMT2A
SCHEMBL6673835 0.82 RXFP1 (1.00) RXFP1SIGMAR1POLBKDM4EHSP90AA1
SCHEMBL4468180 0.82 RXFP1 (0.66) RXFP1SIGMAR1L3MBTL1TSHRPOLB

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-20090111795-A1 Multimers of Heterocyclic Compounds and Their Use ARGENTA DISCOVERY LIMITED (GB) 2009-04-30 US disclosed
US-20090111795-A1 Multimers of Heterocyclic Compounds and Their Use ARGENTA DISCOVERY LIMITED (GB) 2009-04-30 US disclosed
US-20090105268-A1 Dihydropyrimidone Multimers and Their Use as Human Neutrophil, Elastase Inhibitors ARGENTA DISCOVERY LIMITED (GB) 2009-04-23 US disclosed
US-20090105268-A1 Dihydropyrimidone Multimers and Their Use as Human Neutrophil, Elastase Inhibitors ARGENTA DISCOVERY LIMITED (GB) 2009-04-23 US disclosed
WO-2006136857-A1 DIHYDROPYRIMIDONE MULTIMERS AND THEIR USE AS HUMAN NEUTROPHIL ELASTASE INHIBITORS ARGENTA DISCOVERY LIMITED (GB) 2006-12-28 WO 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 (2 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-20090105268-A1 Dihydropyrimidone Multimers and Their Use as Human Neutrophil, Elastase Inhibitors SERPINB1, ELANE, MPO RXFP1 3826/4885SIGMAR1 4501/4885L3MBTL1 903/4885
US-20090111795-A1 Multimers of Heterocyclic Compounds and Their Use MRM1, ME2, SDHA RXFP1 3218/4885SIGMAR1 3625/4885L3MBTL1 268/4885

“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.