SCHEMBL4397747

SCHEMBL4397747

CC(C)(C)C(NC(=O)O)[C@@H]1CCN(Cc2ccccc2)C1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 2/20 0.49
BACE1 P56817 1/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
KDM4E B2RXH2 1/20 0.46
POLB P06746 1/20 0.46
ABL1 P00519 1/20 0.45
RIN1 Q13671 1/20 0.45
SIGMAR1 Q99720 1/20 0.45
BCHE P06276 1/20 0.45
ACHE P22303 1/20 0.45

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
SCHEMBL3524491 1.00 SCN4A (0.49) SCN4ABACE1MEN1KMT2AKDM4E
SCHEMBL1995214 0.85 SCN4A (0.47) SCN4ABACE1MEN1KMT2APOLB
SCHEMBL1013388 0.81 S1PR1 (0.45) SCN4AKDM4E
SCHEMBL5256067 0.81 DRD4 (0.46) SCN4A
SCHEMBL5260659 0.81 DRD4 (0.46) SCN4A
SCHEMBL2276120 0.80 TP53 (0.34) MEN1KMT2APOLB
SCHEMBL5548245 0.80 SIGMAR1 (0.50) MEN1KMT2APOLBABL1RIN1
SCHEMBL6135010 0.77 BCHE (0.51) BACE1MEN1KMT2ABCHEACHE
SCHEMBL8634682 0.76 BCHE (0.50) BACE1KMT2ABCHEACHE
SCHEMBL9143719 0.76 BCHE (0.50) BACE1KMT2ABCHEACHE

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
EP-2516420-B1 AMINOALKYLPYRIMIDINE DERIVATIVES AS HISTAMINE H4 RECEPTOR ANTAGONISTS MEDICIS PHARMACEUTICAL CORP (US) 2018-08-22 EP disclosed
US-8901146-B2 Aminoalkylpyrimidine derivatives as histamine H4 receptor antagonists MEDICIS PHARMACEUTICAL CORPORATION (US) 2014-12-02 US disclosed
US-20130018031-A1 AMINOALKYLPYRIMIDINE DERIVATIVES AS HISTAMINE H4 RECEPTOR ANTAGONISTS MEDICIS PHARMACEUTICAL CORPORATION (US) 2013-01-17 US disclosed
US-20090306038-A1 2-Aminopyrimidine derivatives as modulators of the histamine H4 receptor activity PALAU PHARMA, S.A. (ES) 2009-12-10 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 (2 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-20130018031-A1 AMINOALKYLPYRIMIDINE DERIVATIVES AS HISTAMINE H4 RECEPTOR ANTAGONISTS HRH4, HRH2, HRH3 SCN4A 228/4885BACE1 4579/4885MEN1 3694/4885
US-20090306038-A1 2-Aminopyrimidine derivatives as modulators of the histamine H4 receptor activity HRH4, HRH2, HRH3 SCN4A 616/4885BACE1 4548/4885MEN1 3414/4885

“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.