SCHEMBL3151503

SCHEMBL3151503

CCCS(=O)(=O)c1ccc(-c2ccc(N3CCN(C(C)C)CC3)nn2)cc1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.47
MAPT P10636 7/20 0.46
NPC1 O15118 3/20 0.43
THRB P10828 1/20 0.42
RAB9A P51151 2/20 0.42
TP53 P04637 3/20 0.41
POLB P06746 1/20 0.41
HRH3 Q9Y5N1 1/20 0.40

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
SCHEMBL3160312 0.93 MAPT (0.48) LMNAMAPTNPC1THRBRAB9A
SCHEMBL3151043 0.92 LMNA (0.49) LMNAMAPTNPC1THRBRAB9A
SCHEMBL3970658 0.84 MAPT (0.46) LMNAMAPTNPC1THRBTP53
SCHEMBL13451195 0.78 SCD (0.46) LMNAMAPTNPC1THRBRAB9A
SCHEMBL3150199 0.77 NPC1 (0.41) LMNAMAPTNPC1THRBRAB9A
SCHEMBL3159788 0.77 NPC1 (0.42) LMNAMAPTNPC1THRBRAB9A
SCHEMBL3150420 0.76 MAPT (0.50) MAPTNPC1RAB9ATP53HRH3
SCHEMBL3972252 0.76 MAPT (0.50) LMNAMAPTNPC1THRBRAB9A
SCHEMBL1744869 0.76 KDM4E (0.54) MAPTNPC1RAB9ATP53HRH3
SCHEMBL3184753 0.76 NPC1 (0.59) MAPTNPC1RAB9ATP53HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1651615-B1 PYRIDAZINYL- PIPERAZINES AND THEIR USE AS HISTAMINE H3 RECEPTOR LIGANDS HIGH POINT PHARMACEUTICALS LLC (US) 2010-03-17 EP claimed
EP-1651615-B1 PYRIDAZINYL- PIPERAZINES AND THEIR USE AS HISTAMINE H3 RECEPTOR LIGANDS HIGH POINT PHARMACEUTICALS LLC (US) 2010-03-17 EP disclosed
US-7294626-B2 Piperazines NOVO NORDISK A/S (DK) 2007-11-13 US disclosed
US-7294626-B2 Piperazines NOVO NORDISK A/S (DK) 2007-11-13 US disclosed
US-7294626-B2 Piperazines NOVO NORDISK A/S (DK) 2007-11-13 US disclosed
US-20060173012-A1 Novel piperazines NOVO NORDISK A/S (DK) 2006-08-03 US disclosed
EP-1651615-A1 PYRIDAZINYL- PIPERAZINES AND THEIR USE AS HISTAMINE H3 RECEPTOR LIGANDS NOVO NORDISK A/S (DK) 2006-05-03 EP disclosed
WO-2005009976-A1 PYRIDAZINYL- PIPERAZINES AND THEIR USE AS HISTAMINE H3 RECEPTOR LIGANDS NOVO NORDISK A/S (DK) 2005-02-03 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-20060173012-A1 Novel piperazines HRH3, HRH2, HRH4 LMNA 4299/4885MAPT 2598/4885NPC1 2418/4885

“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.