SCHEMBL4975779

SCHEMBL4975779

CN1CCC(NC(=O)NCc2ccc(Oc3ccccc3)cc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.59
RAB9A P51151 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
NPC1 O15118 1/20 0.56
MCHR1 Q99705 4/20 0.55
EPHX1 P07099 3/20 0.55
HPGD P15428 2/20 0.55
EPHX2 P34913 1/20 0.54
HRH3 Q9Y5N1 4/20 0.53
SSTR4 P31391 1/20 0.52
LIPG Q9Y5X9 1/20 0.49
MAPK14 Q16539 1/20 0.48
MAPT P10636 1/20 0.47

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
SCHEMBL14263114 0.89 DRD4 (0.73) DRD4RAB9ASMN1; SMN2MCHR1EPHX1
SCHEMBL4980231 0.86 RAB9A (0.74) DRD4RAB9ASMN1; SMN2NPC1MCHR1
SCHEMBL4984077 0.82 NPC1 (0.55) RAB9ASMN1; SMN2NPC1MCHR1EPHX1
SCHEMBL4978994 0.82 SMN1; SMN2 (0.72) DRD4RAB9ASMN1; SMN2NPC1MCHR1
SCHEMBL3653016 0.81 HTR2A (0.62) DRD4RAB9ASMN1; SMN2NPC1MCHR1
SCHEMBL14263119 0.81 RAB9A (0.54) DRD4RAB9ASMN1; SMN2NPC1MCHR1
SCHEMBL13242298 0.81 DRD4 (0.66) DRD4RAB9ASMN1; SMN2MCHR1EPHX1
SCHEMBL4982545 0.81 MCHR1 (0.66) DRD4RAB9ASMN1; SMN2NPC1MCHR1
SCHEMBL4981939 0.81 EPHX1 (0.71) DRD4RAB9ASMN1; SMN2NPC1MCHR1
SCHEMBL4979809 0.80 LMNA (0.56) DRD4EPHX2SSTR4MAPT

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 DRD4 102/4885RAB9A 1386/4885SMN1; SMN2 4046/4885

“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.