SCHEMBL5714756

SCHEMBL5714756

O=C(Oc1ccc(CSc2ncc[nH]2)cc1)N1CCN(CCc2ccccn2)CC1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.47
THRB P10828 3/20 0.45
LMNA P02545 1/20 0.43
HDAC1 Q13547 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 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
SCHEMBL5714254 0.95 TP53 (0.42) TP53THRBLMNAHDAC1KDM4E
SCHEMBL5714726 0.92 TP53 (0.47) TP53THRBLMNA
SCHEMBL6102510 0.91 KDM4E (0.49) HDAC1KDM4EALDH1A1
SCHEMBL6102799 0.88 THRB (0.39) TP53THRBLMNAHDAC1KDM4E
SCHEMBL5714383 0.88 THRB (0.39) TP53THRBHDAC1
SCHEMBL5715120 0.87 GRIN2B (0.45) TP53THRBLMNA
SCHEMBL5714702 0.87 THRB (0.39) TP53THRBLMNAHDAC1KDM4E
SCHEMBL5714778 0.86 THRB (0.39) THRBHDAC1
SCHEMBL5714346 0.86 KDM4E (0.45) HDAC1KDM4EALDH1A1
SCHEMBL5715036 0.86 THRB (0.40) TP53THRBHDAC1

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 TP53 2326/4885THRB 598/4885LMNA 1939/4885

“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.