SCHEMBL3597262

SCHEMBL3597262

[NH]c1ccc2c(c1)COC(=O)N2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.51
CYP11B2 P19099 2/20 0.51
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
KCNH2 Q12809 1/20 0.37
GRIN2D O15399 1/20 0.37
GRIN3B O60391 1/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2A Q12879 1/20 0.37
GRIN2B Q13224 1/20 0.37
GRIN2C Q14957 1/20 0.37
GRIN3A Q8TCU5 1/20 0.37
CTSC P53634 1/20 0.35
SYK P43405 2/20 0.33
GRIA1 P42261 1/20 0.33
AHR P35869 1/20 0.33
CPT2 P23786 2/20 0.31
CPT1A P50416 2/20 0.31
CPT1B Q92523 1/20 0.31
MMP12 P39900 1/20 0.30

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
SCHEMBL3586627 0.86 CYP11B1 (0.41) CYP11B1CYP11B2PDE3BPDE3AKCNH2
SCHEMBL30695802 0.79 CYP11B1 (0.51) CYP11B1CYP11B2PDE3BPDE3AKCNH2
SCHEMBL3068531 0.79 AHR (0.56) CYP11B1CYP11B2PDE3BPDE3AKCNH2
SCHEMBL3597266 0.79 LMNA (0.51) CYP11B1CYP11B2PDE3BPDE3AKCNH2
SCHEMBL434348 0.79 CYP11B1 (0.51) CYP11B1CYP11B2PDE3BPDE3AKCNH2
SCHEMBL787497 0.79 CYP11B1 (0.51) CYP11B1CYP11B2PDE3BPDE3AKCNH2
SCHEMBL31261247 0.79 CYP11B1 (0.51) CYP11B1CYP11B2PDE3BPDE3AKCNH2
SCHEMBL10916724 0.79 CYP11B1 (0.51) CYP11B1CYP11B2PDE3BPDE3AKCNH2
SCHEMBL13692913 0.79 CYP11B1 (0.51) CYP11B1CYP11B2PDE3BPDE3AKCNH2
SCHEMBL4395266 0.76 CYP11B1 (0.46) CYP11B1CYP11B2PDE3BPDE3AKCNH2

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-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
EP-2128157-A1 HETEROCYCLIDENE-N-(ARYL)ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2009-12-02 EP 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-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE CCNY, CCND3, NSD3 CYP11B1 162/4885CYP11B2 165/4885PDE3B 3066/4885

“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.