SCHEMBL5714798

SCHEMBL5714798

Cc1cccc(CCCN2CCN(C(=O)Oc3ccc(CCc4cccc(C)n4)cc3)CC2)n1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.47
HTR2A P28223 2/20 0.47
OPRM1 P35372 2/20 0.47
ADORA3 P0DMS8 1/20 0.47
HTR7 P34969 1/20 0.47
FAAH O00519 6/20 0.47
DRD2 P14416 1/20 0.46
MGLL Q99685 2/20 0.45
HRH1 P35367 3/20 0.42
HRH2 P25021 2/20 0.42
HTR1A P08908 1/20 0.41
DRD4 P21917 1/20 0.41

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
SCHEMBL6102347 0.94 KCNH2 (0.43) SIGMAR1HTR2AOPRM1ADORA3HTR7
SCHEMBL5714939 0.93 SIGMAR1 (0.46) SIGMAR1HTR2AOPRM1ADORA3HTR7
SCHEMBL5714867 0.93 SIGMAR1 (0.44) SIGMAR1HTR2AOPRM1ADORA3HTR7
SCHEMBL5715373 0.92 SIGMAR1 (0.43) SIGMAR1HTR2AOPRM1ADORA3HTR7
SCHEMBL5715186 0.92 SIGMAR1 (0.43) SIGMAR1HTR2AOPRM1ADORA3HTR7
SCHEMBL5714848 0.91 FAAH (0.42) SIGMAR1HTR2AOPRM1ADORA3HTR7
SCHEMBL6102814 0.90 KDM4E (0.47) SIGMAR1HTR2AOPRM1ADORA3HTR7
SCHEMBL5715560 0.89 FAAH (0.43) SIGMAR1HTR2AOPRM1ADORA3HTR7
SCHEMBL5715385 0.89 KMT2A (0.48) FAAHMGLL
SCHEMBL5714841 0.89 SIGMAR1 (0.43) SIGMAR1HTR2AOPRM1ADORA3HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2006527212-A 2006-11-30 JP claimed
US-20060160820-A1 Substituted piperazine carbamates NOVO NORDISK A/S (DK) 2006-07-20 US claimed
EP-1636187-A1 SUBSTITUTED PIPERAZINE CARBAMATES FOR USE AS INHIBITORS OF HORMONE SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2006-03-22 EP claimed
WO-2004111004-A1 SUBSTITUTED PIPERAZINE CARBAMATES FOR USE AS INHIBITORS OF HORMONE SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2004-12-23 WO claimed
US-20060160820-A1 Substituted piperazine carbamates NOVO NORDISK A/S (DK) 2006-07-20 US disclosed
EP-1636187-A1 SUBSTITUTED PIPERAZINE CARBAMATES FOR USE AS INHIBITORS OF HORMONE SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2006-03-22 EP disclosed
WO-2004111004-A1 SUBSTITUTED PIPERAZINE CARBAMATES FOR USE AS INHIBITORS OF HORMONE SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2004-12-23 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 (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-20060160820-A1 Substituted piperazine carbamates LIPE, PNLIP, LPL SIGMAR1 2726/4885HTR2A 1618/4885OPRM1 3563/4885

“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.