SCHEMBL4979582

SCHEMBL4979582

CN1CCC(NC(=O)NCc2ccc(C(F)(F)F)cc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 5/20 0.59
HPGD P15428 1/20 0.52
RAB9A P51151 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
EPHX1 P07099 1/20 0.52
DRD4 P21917 1/20 0.52
EPHX2 P34913 7/20 0.52
MCHR1 Q99705 2/20 0.51
CHRNB2 P17787 1/20 0.51
CHRNB4 P30926 1/20 0.51
CHRNA3 P32297 1/20 0.51
CHRNA4 P43681 1/20 0.51
TEAD1 P28347 2/20 0.50
KCNH2 Q12809 1/20 0.50

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
SCHEMBL4014107 0.88 EPHX2 (0.69) HPGDRAB9ASMN1; SMN2EPHX1DRD4
SCHEMBL4980678 0.86 UBE2M (0.54) DRD4EPHX2MCHR1TEAD1KCNH2
SCHEMBL4982545 0.86 MCHR1 (0.66) HPGDRAB9ASMN1; SMN2EPHX1DRD4
SCHEMBL13247314 0.85 RAB9A (0.54) HPGDRAB9ASMN1; SMN2EPHX1DRD4
SCHEMBL4984077 0.84 NPC1 (0.55) SLC6A5RAB9ASMN1; SMN2EPHX1EPHX2
SCHEMBL4978994 0.84 SMN1; SMN2 (0.72) HPGDRAB9ASMN1; SMN2EPHX1DRD4
SCHEMBL14263119 0.83 RAB9A (0.54) SLC6A5HPGDRAB9ASMN1; SMN2EPHX1
SCHEMBL4981939 0.83 EPHX1 (0.71) HPGDRAB9ASMN1; SMN2EPHX1DRD4
SCHEMBL14263114 0.83 DRD4 (0.73) HPGDRAB9ASMN1; SMN2EPHX1DRD4
SCHEMBL4980231 0.81 RAB9A (0.74) HPGDRAB9ASMN1; SMN2EPHX1DRD4

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 SLC6A5 2039/4885HPGD 1184/4885RAB9A 1386/4885

“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.