SCHEMBL12845835

SCHEMBL12845835

C=C1OB(c2ccc3c(c2)C(=O)NCC(=O)N3)OC1(C)C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
MTOR P42345 1/20 0.32
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 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
SCHEMBL12646193 0.84 CLK4 (0.39)
SCHEMBL394338 0.83 PRMT5 (0.37) PDE3BPDE3AMTORCYP11B1CYP11B2
SCHEMBL328270 0.82 DAPK3 (0.38)
SCHEMBL12049915 0.78 AHR (0.42) PDE3BPDE3ACYP11B1CYP11B2
SCHEMBL13348258 0.77 PPOX (0.37)
SCHEMBL14792947 0.77 PDE3B (0.39) PDE3BPDE3ACYP11B1CYP11B2
SCHEMBL14114009 0.76 EIF2AK2 (0.44) PDE3BPDE3ACYP11B1CYP11B2
SCHEMBL13266843 0.74 MMP12 (0.50) PDE3BPDE3A
SCHEMBL12094128 0.72 NPC1 (0.31)
SCHEMBL10224843 0.72 PBRM1 (0.39)

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-7902189-B2 antitumor agent, anticarcinogenic agents; 7-Chloro-2-((2S,6R)-2,6-dimethyl-morpholin-4-yl)-4-morpholin-4-yl-pyrido[2,3-d]pyrimidine; inhibitors of mTOR kinase ASTRAZENECA AB (SE) 2011-03-08 US disclosed
US-20080081809-A1 Novel Compounds KUDOS PHARMACEUTICALS LIMITED (GB) 2008-04-03 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-20080081809-A1 Novel Compounds SLC10A1, ABCB11, PKD1 PDE3B 1357/4885PDE3A 1649/4885MTOR 203/4885

“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.