SCHEMBL2882230

SCHEMBL2882230

CN(C)C1CCN(C(=O)c2ccc(Nc3ccccn3)cc2)C1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
VNN1 O95497 1/20 0.53
HRH3 Q9Y5N1 6/20 0.53
L3MBTL3 Q96JM7 2/20 0.52
ATR Q13535 1/20 0.51
IKBKB O14920 1/20 0.50
CHUK O15111 1/20 0.50
IKBKG Q9Y6K9 1/20 0.50
CDK1 P06493 2/20 0.49
CDK2 P24941 2/20 0.49
MAP3K12 Q12852 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
PDK2 Q15119 1/20 0.46
GRM5 P41594 1/20 0.46

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
SCHEMBL2882904 0.88 IKBKB (0.57) VNN1HRH3L3MBTL3ATRIKBKB
SCHEMBL2890309 0.81 VNN1 (0.52) VNN1L3MBTL3CDK1CDK2MAP3K12
SCHEMBL2889563 0.81 IKBKB (0.53) VNN1HRH3L3MBTL3ATRIKBKB
SCHEMBL2881626 0.80 HRH3 (0.50) VNN1HRH3L3MBTL3ATRIKBKB
SCHEMBL10293555 0.78 L3MBTL3 (0.69) HRH3L3MBTL3ATRL3MBTL1PDK2
SCHEMBL10293598 0.78 L3MBTL3 (0.69) HRH3L3MBTL3ATRL3MBTL1PDK2
SCHEMBL6202647 0.77 L3MBTL3 (0.67) HRH3L3MBTL3L3MBTL1PDK2
SCHEMBL5909215 0.77 L3MBTL3 (0.67) HRH3L3MBTL3L3MBTL1PDK2
SCHEMBL2888158 0.75 L3MBTL3 (0.48) HRH3L3MBTL3ATRIKBKBCHUK
SCHEMBL2889902 0.75 ATR (0.61) HRH3L3MBTL3ATRIKBKBCHUK

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
EP-2027086-A2 N-BENZOYL-AND N-BENZYLPYRROLIDIN-3-YLAMINES AS HISTAMINE-3 ANTAGONISTS Wyeth (US) 2009-02-25 EP claimed
WO-2007136668-A2 N-BENZOYL-AND N-BENZYLPYRROLIDIN-3-YLAMINES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2007-11-29 WO claimed
US-20070270440-A1 N-benzoyl- and N-benzylpyrrolidin-3-ylamines as histamine-3 antagonists WYETH (US) 2007-11-22 US claimed
US-7842715-B2 N-benzoyl- and N-benzylpyrrolidin-3-ylamines as histamine-3 antagonists WYETH LLC (US) 2010-11-30 US disclosed
EP-2027086-A2 N-BENZOYL-AND N-BENZYLPYRROLIDIN-3-YLAMINES AS HISTAMINE-3 ANTAGONISTS Wyeth (US) 2009-02-25 EP disclosed
WO-2007136668-A9 N-BENZOYL-AND N-BENZYLPYRROLIDIN-3-YLAMINES AS HISTAMINE-3 ANTAGONISTS WYETH CORP (US) 2008-03-27 WO disclosed
WO-2007136668-A2 N-BENZOYL-AND N-BENZYLPYRROLIDIN-3-YLAMINES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2007-11-29 WO disclosed
US-20070270440-A1 N-benzoyl- and N-benzylpyrrolidin-3-ylamines as histamine-3 antagonists WYETH (US) 2007-11-22 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-20070270440-A1 N-benzoyl- and N-benzylpyrrolidin-3-ylamines as histamine-3 antagonists HRH4, HRH3, HRH2 VNN1 1225/4885HRH3 2/4885L3MBTL3 2436/4885

“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.