SCHEMBL14587775

SCHEMBL14587775

CC(C)(C)CC1CCN(c2ncc[nH]2)CC1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.34
AKT2 P31751 2/20 0.34
GSK3B P49841 1/20 0.34
HRH3 Q9Y5N1 6/20 0.33
JAK3 P52333 2/20 0.33
HIPK2 Q9H2X6 1/20 0.33
HRH4 Q9H3N8 3/20 0.33
GRIN2B Q13224 2/20 0.32
LCK P06239 1/20 0.32
F2RL1 P55085 1/20 0.32
HSD11B1 P28845 1/20 0.32
HTR2B P41595 2/20 0.32
GRIN2A Q12879 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
JAK2 O60674 1/20 0.31

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
SCHEMBL4790799 0.81 ALOX15 (0.36) ALOX15AKT2GSK3BHRH3JAK3
SCHEMBL6281359 0.75 AKT2 (0.49) ALOX15AKT2GSK3BHRH3HIPK2
SCHEMBL24419090 0.75 GRIN2B (0.57) GRIN2BGRIN2A
SCHEMBL300491 0.72 ALOX15 (0.41) ALOX15AKT2JAK3HIPK2F2RL1
SCHEMBL6840293 0.71 NPC1 (0.41) HRH3HRH4
Hydrochloric Acid SCHEMBL9200760 0.70 ALOX15 (0.39) ALOX15JAK3HIPK2F2RL1HTR2B
SCHEMBL311710 0.70 BCHE (0.42) ALOX15AKT2HRH3JAK3HIPK2
Hydrochloric Acid SCHEMBL29956711 0.70 HIPK2 (0.37) ALOX15AKT2GSK3BJAK3HIPK2
SCHEMBL14587776 0.70 TRPC3 (0.68)
SCHEMBL556899 0.69 LMNA (0.39) HIPK2F2RL1

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-20070032475-A1 Novel compounds useful for bradykinin B1 receptor antagonism ELAN PHARMACEUTICALS, INC. 2007-02-08 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-20070032475-A1 Novel compounds useful for bradykinin B1 receptor antagonism BDKRB1, BDKRB2, NPBWR1 ALOX15 778/4885AKT2 3360/4885GSK3B 4572/4885

“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.