SCHEMBL5714896

SCHEMBL5714896

Cn1ccnc1SCCc1ccc(OC(=O)N2CCN(Cc3ccncn3)CC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.39
ALDH1A1 P00352 2/20 0.38
KMT2A Q03164 1/20 0.38
THRB P10828 1/20 0.38
MGLL Q99685 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
POLB P06746 2/20 0.37

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
SCHEMBL5714454 0.91 SMN1; SMN2 (0.47) ALDH1A1THRBMGLLNPC1RAB9A
SCHEMBL5715045 0.89 ALDH1A1 (0.49) MAPTALDH1A1KMT2A
SCHEMBL5714332 0.88 MAPT (0.38) MAPTALDH1A1KMT2ATHRBMGLL
SCHEMBL5715079 0.86 MAPT (0.40) MAPTALDH1A1KMT2AMGLLNPC1
SCHEMBL5715169 0.86 CYP1A2 (0.42) ALDH1A1KMT2ATHRBMGLLSMN1; SMN2
SCHEMBL5714851 0.85 KDM4E (0.48) ALDH1A1POLB
SCHEMBL5714923 0.85 KMT2A (0.40) MAPTALDH1A1KMT2AMGLLPOLB
SCHEMBL5715010 0.83 ALDH1A1 (0.44) ALDH1A1MGLLCYP1A2CYP3A4CYP2C9
SCHEMBL5714941 0.82 MGLL (0.38) ALDH1A1THRBMGLLCYP1A2CYP3A4
SCHEMBL5715606 0.82 THRB (0.42) MAPTALDH1A1KMT2ATHRBNPC1

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 MAPT 4348/4885ALDH1A1 1504/4885KMT2A 1677/4885

“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.