SCHEMBL4980231

SCHEMBL4980231

COc1ccc(CNC(=O)NC2CCN(C)CC2)cc1

nearest known ligand 0.74

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.74
SMN1; SMN2 Q16637 2/20 0.74
NPC1 O15118 2/20 0.74
MCHR1 Q99705 5/20 0.67
HRH3 Q9Y5N1 1/20 0.67
ALDH1A1 P00352 1/20 0.54
EPHX1 P07099 2/20 0.53
HPGD P15428 1/20 0.53
DRD4 P21917 1/20 0.53
EPHX2 P34913 2/20 0.51
SIGMAR1 Q99720 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
SCHEMBL4981608 0.88 SMN1; SMN2 (0.57) RAB9ASMN1; SMN2NPC1MCHR1HRH3
SCHEMBL4983996 0.87 RAB9A (0.56) RAB9ASMN1; SMN2NPC1MCHR1HRH3
SCHEMBL4975779 0.86 DRD4 (0.59) RAB9ASMN1; SMN2NPC1MCHR1HRH3
SCHEMBL24011436 0.86 SMN1; SMN2 (0.63) RAB9ASMN1; SMN2NPC1MCHR1HRH3
SCHEMBL4984077 0.85 NPC1 (0.55) RAB9ASMN1; SMN2NPC1MCHR1HRH3
SCHEMBL4977767 0.85 MCHR1 (0.65) RAB9ASMN1; SMN2NPC1MCHR1HRH3
SCHEMBL24011481 0.85 NPC1 (0.68) RAB9ASMN1; SMN2NPC1MCHR1HRH3
SCHEMBL4978994 0.85 SMN1; SMN2 (0.72) RAB9ASMN1; SMN2NPC1MCHR1HRH3
SCHEMBL14263119 0.84 RAB9A (0.54) RAB9ASMN1; SMN2NPC1MCHR1HRH3
SCHEMBL3653016 0.84 HTR2A (0.62) RAB9ASMN1; SMN2NPC1MCHR1HRH3

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 RAB9A 1386/4885SMN1; SMN2 4046/4885NPC1 4132/4885

“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.