SCHEMBL4085585

SCHEMBL4085585

Cc1cc(CNC=O)n(C)n1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
P2RX7 Q99572 1/20 0.37
KCNH2 Q12809 8/20 0.35
GRIN2B Q13224 1/20 0.35
MAPK1 P28482 1/20 0.34
PDE10A Q9Y233 1/20 0.33
SYK P43405 1/20 0.33
ADH1B P00325 1/20 0.33
ADH1C P00326 1/20 0.33
ADH1A P07327 1/20 0.33
ADH7 P40394 1/20 0.33
RIPK3 Q9Y572 1/20 0.32
FFAR1 O14842 1/20 0.32
MPO P05164 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL2077294 0.77 SMN1; SMN2 (0.42) DAOSMN1; SMN2P2RX7KCNH2GRIN2B
SCHEMBL2077292 0.76 KCNH2 (0.38) DAOSMN1; SMN2P2RX7KCNH2GRIN2B
SCHEMBL25633056 0.76 DAO (0.38) DAOSMN1; SMN2P2RX7KCNH2GRIN2B
SCHEMBL13736836 0.75 P2RX7 (0.45) DAOSMN1; SMN2P2RX7MAPK1SYK
SCHEMBL15273627 0.74 IRAK4 (0.39) SMN1; SMN2P2RX7KCNH2GRIN2BPDE10A
SCHEMBL16136258 0.74 P2RX7 (0.44) DAOSMN1; SMN2P2RX7MAPK1SYK
SCHEMBL243531 0.72
SCHEMBL23576608 0.72 P2RX7 (0.43) DAOSMN1; SMN2P2RX7MAPK1SYK
SCHEMBL324196 0.71 FFAR1 (0.40) DAOSMN1; SMN2P2RX7KCNH2GRIN2B
SCHEMBL19072033 0.71 DAO (0.36) DAOSMN1; SMN2P2RX7KCNH2GRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090042929-A1 11-Beta-Hydroxysteroid Dehydrogenase Inhibitors STERIX LIMITED (GB) 2009-02-12 US disclosed
EP-1861384-A1 11-BETA-HYDROXYSTEROID DEHYDROGENASE INHIBITORS Sterix Limited (GB) 2007-12-05 EP disclosed
WO-2006100502-A1 11-BETA-HYDROXYSTEROID DEHYDROGENASE INHIBITORS STERIX LIMITED (GB) 2006-09-28 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-20090042929-A1 11-Beta-Hydroxysteroid Dehydrogenase Inhibitors HSD3B1, HSD3B2, HSD11B1 DAO 846/4885SMN1; SMN2 4801/4885P2RX7 3719/4885

“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.