SCHEMBL1812972

SCHEMBL1812972

Cc1cc2ccccc2n1-c1ccc(C(=O)N2CCC(N(C)C)C2)cc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.56
L3MBTL3 Q96JM7 2/20 0.51
PDK2 Q15119 1/20 0.48
JAK2 O60674 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
POLB P06746 1/20 0.44
ATR Q13535 2/20 0.44
MALT1 Q9UDY8 1/20 0.42
KCNH2 Q12809 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
SCHEMBL1814566 0.87 HRH3 (0.55) HRH3L3MBTL3PDK2JAK2ATR
SCHEMBL2886071 0.82 HRH3 (0.71) HRH3L3MBTL3PDK2
SCHEMBL1813947 0.82 HRH3 (0.70) HRH3L3MBTL3L3MBTL1
SCHEMBL1812862 0.82 HRH3 (0.71) HRH3KCNH2
SCHEMBL1812524 0.81 HRH3 (0.55) HRH3L3MBTL3PDK2JAK2L3MBTL1
SCHEMBL1811086 0.80 HRH3 (0.72) HRH3ATRKCNH2
SCHEMBL1814327 0.80 HRH3 (0.72) HRH3ATRKCNH2
SCHEMBL1810394 0.80 HRH3 (0.72) HRH3ATRKCNH2
SCHEMBL16151197 0.78 MAPT (0.49) POLB
SCHEMBL17404603 0.78 SIGMAR1 (0.54) HRH3L3MBTL1POLB

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-7935719-B2 N-substituted-azacyclylamines as histamine-3 antagonists WYETH LLC (US) 2011-05-03 US disclosed
EP-2074088-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS Wyeth (US) 2009-07-01 EP disclosed
US-20080119458-A1 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-05-22 US disclosed
WO-2008045371-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-04-17 WO 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-20080119458-A1 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS HNMT, HRH4, HRH3 HRH3 3/4885L3MBTL3 2875/4885PDK2 4731/4885

“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.