SCHEMBL5714548

SCHEMBL5714548

Cc1cccc(CN2CCN(C(=O)Oc3ccc(CSc4ncc[nH]4)cc3)CC2)n1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
HDAC1 Q13547 1/20 0.37
MGLL Q99685 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL5714628 0.92 KMT2A (0.40) KMT2AALDH1A1KDM4EMGLLCYP1A2
SCHEMBL6102799 0.92 THRB (0.39) ALDH1A1KDM4EHDAC1CYP3A4LMNA
SCHEMBL5714179 0.90 ADORA3 (0.39) HDAC1MGLL
SCHEMBL5714609 0.89 ALDH1A1 (0.36) KMT2AALDH1A1KDM4ECYP1A2CYP3A4
SCHEMBL6102510 0.88 KDM4E (0.49) KMT2AALDH1A1KDM4EHDAC1MGLL
SCHEMBL5714025 0.86 SMN1; SMN2 (0.41) ALDH1A1KDM4EHDAC1CYP1A2CYP3A4
SCHEMBL5715318 0.85 KMT2A (0.40) KMT2AALDH1A1KDM4ELMNA
SCHEMBL5715702 0.84 GRIN2B (0.39)
SCHEMBL6101827 0.84 MGLL (0.39) ALDH1A1KDM4EHDAC1MGLLCYP1A2
SCHEMBL6102344 0.83 CYP1A2 (0.39) ALDH1A1KDM4EHDAC1MGLLCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060160820-A1 Substituted piperazine carbamates NOVO NORDISK A/S (DK) 2006-07-20 US 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 KMT2A 1677/4885ALDH1A1 1504/4885KDM4E 1090/4885

“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.