SCHEMBL2883864

SCHEMBL2883864

COC(=O)c1ccc(Cc2nc3ccccc3n2CCc2ccccc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.71
TBXA2R P21731 4/20 0.71
L3MBTL1 Q9Y468 2/20 0.59
POLB P06746 3/20 0.58
GAA P10253 1/20 0.55
PTGDR2 Q9Y5Y4 1/20 0.55
LMNA P02545 3/20 0.55
MAPT P10636 2/20 0.55
RECQL P46063 1/20 0.55
JAK2 O60674 1/20 0.54
JAK1 P23458 1/20 0.54
TYK2 P29597 1/20 0.54
JAK3 P52333 1/20 0.54
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
KDM4E B2RXH2 1/20 0.53

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
SCHEMBL2881289 0.84 DRD2 (0.68) DRD2TBXA2RGAAPTGDR2MAPT
SCHEMBL2901910 0.83 DRD2 (0.70) DRD2TBXA2RGAAPTGDR2MEN1
SCHEMBL15314759 0.83 POLB (0.74) L3MBTL1POLBLMNAMAPTRECQL
SCHEMBL13085873 0.79 DRD2 (0.58) DRD2TBXA2RPTGDR2MAPT
SCHEMBL15643536 0.78 MAPT (0.65) DRD2TBXA2RLMNAMAPTMEN1
SCHEMBL9201172 0.78 DRD2 (0.78) DRD2TBXA2RPOLBMAPT
SCHEMBL23997462 0.77 DRD2 (0.75) DRD2TBXA2RPTGDR2LMNAMAPT
SCHEMBL30336823 0.77 DRD2 (0.75) DRD2TBXA2RPTGDR2LMNAMAPT
SCHEMBL15643422 0.77 DRD2 (0.77) DRD2TBXA2RPTGDR2MAPT
SCHEMBL31542083 0.77 POLB (0.56) DRD2TBXA2RL3MBTL1POLBMEN1

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 8 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 disclosed
US-7820825-B2 N-substituted-azacyclylamines as histamine-3 antagonists WYETH LLC (US) 2010-10-26 US disclosed
US-7820825-B2 N-substituted-azacyclylamines as histamine-3 antagonists WYETH LLC (US) 2010-10-26 US disclosed
EP-1994022-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS Wyeth a Corporation of the State of Delaware (US) 2008-11-26 EP disclosed
WO-2007108936-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2007-09-27 WO disclosed
US-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists WYETH (US) 2007-09-20 US disclosed
US-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists WYETH (US) 2007-09-20 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 DRD2 300/4885TBXA2R 434/4885L3MBTL1 4513/4885

“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.