SCHEMBL2883672

SCHEMBL2883672

C[C@H]1CCCN1C1CCN(C(=O)c2ccc(Cn3cnc4cc(F)ccc43)cc2)C1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 13/20 0.58
PDE5A O76074 1/20 0.42
CYP11B2 P19099 1/20 0.42
HPGD P15428 1/20 0.42
PKM P14618 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ATM Q13315 1/20 0.41
RCE1 Q9Y256 1/20 0.41

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
SCHEMBL2886645 1.00 HRH3 (0.58) HRH3PDE5ACYP11B2HPGDPKM
SCHEMBL2884832 0.91 HRH3 (0.59) HRH3HPGD
SCHEMBL2884382 0.88 HRH3 (0.60) HRH3HPGD
SCHEMBL2885521 0.88 HRH3 (0.75) HRH3CYP11B2SMN1; SMN2
SCHEMBL2884787 0.88 HRH3 (0.75) HRH3CYP11B2SMN1; SMN2
SCHEMBL2885914 0.88 HRH3 (0.75) HRH3CYP11B2SMN1; SMN2
Hydrochloric Acid SCHEMBL2883590 0.87 HRH3 (0.74) HRH3CYP11B2SMN1; SMN2
Hydrochloric Acid SCHEMBL2886522 0.87 HRH3 (0.74) HRH3CYP11B2SMN1; SMN2
SCHEMBL2883568 0.87 HRH3 (0.76) HRH3
SCHEMBL2881996 0.87 HRH3 (0.76) HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7820825-B2 N-substituted-azacyclylamines as histamine-3 antagonists WYETH LLC (US) 2010-10-26 US claimed
US-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists WYETH (US) 2007-09-20 US claimed
US-7820825-B2 N-substituted-azacyclylamines as histamine-3 antagonists WYETH LLC (US) 2010-10-26 US disclosed
US-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists WYETH (US) 2007-09-20 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-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists HNMT, HRH4, HRH3 HRH3 3/4885PDE5A 1696/4885CYP11B2 2197/4885

“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.