SCHEMBL4981981

SCHEMBL4981981

Cc1cccc(N2CCN(C(=O)NC3CCN(C)CC3)CC2)n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR3E A5X5Y0 2/20 0.58
HTR3B O95264 2/20 0.58
HTR3A P46098 2/20 0.58
HTR3D Q70Z44 2/20 0.58
HTR3C Q8WXA8 2/20 0.58
RAB9A P51151 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.46
TRPA1 O75762 1/20 0.46
HTR1A P08908 1/20 0.44
HTR2A P28223 1/20 0.44
DRD3 P35462 1/20 0.44
FNTA P49354 1/20 0.44
FNTB P49356 1/20 0.44
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 1/20 0.44
P2RX4 Q99571 1/20 0.44
HSD11B1 P28845 1/20 0.44
SMO Q99835 2/20 0.43
NPC1 O15118 1/20 0.43
CYP1A2 P05177 1/20 0.43

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
SCHEMBL1908854 0.81 HTR3E (0.51) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL11148822 0.81 CKS1B (0.57) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL5462615 0.79 HTR3E (0.77) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL316060 0.77 CA12 (0.57) RAB9ASMN1; SMN2DRD3ALDH1A1
SCHEMBL2127461 0.76 HTR3A (1.00) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL20339488 0.75 HTR3E (0.63) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL27629098 0.75 PDE10A (0.49) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL24151463 0.75 GRM5 (0.53) RAB9ASMN1; SMN2ALDH1A1HSD11B1NPC1
Ammonia Solution, Strong SCHEMBL28472249 0.74 HTR3A (0.96) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL314504 0.74 GAA (0.68) RAB9ASMN1; SMN2ALDH1A1KDM4EP2RX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080064706-A1 Piperidine Derivatives as Histamine H3 Receptor Ligands ASTRAZENECA AB (SE) 2008-03-13 US disclosed
US-20080064706-A1 Piperidine Derivatives as Histamine H3 Receptor Ligands ASTRAZENECA AB (SE) 2008-03-13 US disclosed
US-20080064706-A1 Piperidine Derivatives as Histamine H3 Receptor Ligands ASTRAZENECA AB (SE) 2008-03-13 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-20080064706-A1 Piperidine Derivatives as Histamine H3 Receptor Ligands HRH3, HRH1, HRH4 HTR3E 59/4885HTR3B 34/4885HTR3A 25/4885

“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.