SCHEMBL2148134

SCHEMBL2148134

CN[C@H]1CN(Cc2ccccc2)CC[C@H]1C.CN[C@H]1CN(Cc2ccccc2)CC[C@H]1C.Cc1ccc(C(=O)C(O)(C(=O)O)C(O)(C(=O)O)C(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.48
ACHE P22303 2/20 0.45
BACE1 P56817 2/20 0.45
BCHE P06276 2/20 0.45
SCN4A P35499 2/20 0.44
HRH1 P35367 1/20 0.43
DRD4 P21917 2/20 0.43
KCNH2 Q12809 1/20 0.43
DRD2 P14416 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42
CHRM4 P08173 1/20 0.41
OPRM1 P35372 1/20 0.41
OPRK1 P41145 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
SCHEMBL29601945 1.00 GAA (0.48) GAAACHEBACE1BCHESCN4A
SCHEMBL22497322 0.87 SCN4A (0.47) ACHEBCHESCN4ADRD4DRD2
SCHEMBL1846475 0.84 GAA (0.46) GAAACHEBACE1BCHEHRH1
SCHEMBL5142128 0.83 GAA (0.45) GAAACHEBACE1BCHEHRH1
SCHEMBL2148317 0.83 GAA (0.41) GAAACHEBACE1BCHESCN4A
SCHEMBL2148144 0.83 GAA (0.41) GAAACHEBACE1BCHESCN4A
Acetic Acid SCHEMBL22497325 0.83 SCN4A (0.52) ACHEBACE1BCHESCN4ADRD4
SCHEMBL29631582 0.82 MCHR1 (0.46) ACHESCN4ADRD4DRD2MEN1
SCHEMBL2148139 0.82 GAA (0.46) GAAACHEBACE1BCHESCN4A
Oxalic Acid SCHEMBL29414384 0.81 ALDH1A1 (0.51) ACHEBACE1BCHESCN4ADRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110165183-A1 PIPERIDINE DERIVATIVES AS JAK3 INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2011-07-07 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-20110165183-A1 PIPERIDINE DERIVATIVES AS JAK3 INHIBITORS JAK3, JAK2, JAK1 GAA 4069/4885ACHE 4871/4885BACE1 4680/4885

“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.