SCHEMBL14124209

SCHEMBL14124209

Cc1cnc2c(C(=O)Nc3ccccc3Cl)cnn2c1

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHB3 P54753 13/20 0.71
PDE2A O00408 4/20 0.60
RIPK2 O43353 1/20 0.59
LCK P06239 1/20 0.59
NR3C1 P04150 1/20 0.53
JAK2 O60674 1/20 0.52
CYP1A2 P05177 1/20 0.50
HPGD P15428 1/20 0.50
CYP2C19 P33261 1/20 0.50

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
SCHEMBL14124199 0.84 EPHB3 (0.59) EPHB3RIPK2LCKJAK2CYP1A2
SCHEMBL2873995 0.77 EPHB3 (1.00) EPHB3RIPK2LCK
SCHEMBL18208186 0.75 PDE2A (0.49) EPHB3PDE2A
SCHEMBL18208182 0.75 PDE2A (0.49) EPHB3PDE2A
SCHEMBL22170113 0.74 EPHB3 (1.00) EPHB3RIPK2LCK
SCHEMBL21326698 0.74 PDE2A (0.53) PDE2A
SCHEMBL22640640 0.74 IRAK4 (0.66) EPHB3RIPK2LCKJAK2
SCHEMBL18208224 0.74 PDE2A (0.48) PDE2AJAK2HPGD
SCHEMBL18208227 0.74 PDE2A (0.48) PDE2AJAK2HPGD
SCHEMBL310126 0.74 PDE2A (0.59) PDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080176870-A1 Heterobicyclic metalloprotease inhibitors NOLTE BERT 2008-07-24 US disclosed
US-20080176870-A1 Heterobicyclic metalloprotease inhibitors NOLTE BERT 2008-07-24 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-20080176870-A1 Heterobicyclic metalloprotease inhibitors ADAM17, ADAM8, ADAM10 EPHB3 3762/4885PDE2A 2965/4885RIPK2 3884/4885

“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.