SCHEMBL6100018

SCHEMBL6100018

Cc1nc(CCN2CCN(C(=O)Oc3ccc(CCc4ncccc4C)cc3)CC2)cs1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
THRB P10828 1/20 0.40
TP53 P04637 2/20 0.39
POLB P06746 1/20 0.38
SIGMAR1 Q99720 2/20 0.37
KMT2A Q03164 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
HTR2A P28223 1/20 0.37
HTR7 P34969 1/20 0.37
OPRM1 P35372 1/20 0.37
HRH2 P25021 1/20 0.36
HRH1 P35367 1/20 0.36
KCNH2 Q12809 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 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
SCHEMBL5715423 0.94 LMNA (0.40) LMNATHRBTP53POLBKMT2A
SCHEMBL5715062 0.94 CYP3A4 (0.40) LMNATHRBTP53POLBSIGMAR1
SCHEMBL6101597 0.87 TP53 (0.52) LMNATHRBTP53SIGMAR1ALDH1A1
SCHEMBL6102660 0.86 TP53 (0.42) LMNATHRBTP53POLBSIGMAR1
SCHEMBL5714579 0.84 TP53 (0.49) LMNATHRBTP53ALDH1A1
SCHEMBL5714968 0.84 TP53 (0.42) LMNATHRBTP53POLBSIGMAR1
SCHEMBL5714902 0.84 THRB (0.41) LMNATHRBTP53POLBSIGMAR1
SCHEMBL6102113 0.84 CYP3A4 (0.46) THRBTP53POLBSIGMAR1ADORA3
SCHEMBL5716030 0.84 THRB (0.41) LMNATHRBTP53POLBSIGMAR1
SCHEMBL5715135 0.84 DRD3 (0.43) LMNATHRBTP53SIGMAR1ADORA3

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 2 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

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

“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.