SCHEMBL6256164

SCHEMBL6256164

CCCP(=O)(CCC)C(CCc1nc(C)c[nH]1)c1ccc2c(c1)CC(=O)N2

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 3/20 0.33
CACNG8 Q8WXS5 2/20 0.33
PDE3B Q13370 2/20 0.32
PDE3A Q14432 2/20 0.32
AHR P35869 1/20 0.32
SMYD3 Q9H7B4 4/20 0.32
TBXAS1 P24557 1/20 0.32
BMPR1B O00238 1/20 0.32
BMPR1A P36894 1/20 0.32
TGFBR1 P36897 1/20 0.32
ACVRL1 P37023 1/20 0.32
ACVR1 Q04771 1/20 0.32
MAPKAPK2 P49137 1/20 0.31
GRIN2B Q13224 1/20 0.31
PKM P14618 2/20 0.31
EPHX2 P34913 1/20 0.31
HTR1A P08908 1/20 0.30
DRD2 P14416 1/20 0.30
HTR2A P28223 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
SCHEMBL18885938 0.67 AHR (0.49) GRIA1CACNG8PDE3BPDE3AAHR
SCHEMBL2611053 0.62 AHR (0.56) GRIA1CACNG8PDE3BPDE3AAHR
SCHEMBL280638 0.60 AHR (0.46) GRIA1CACNG8PDE3BPDE3AAHR
SCHEMBL7349900 0.60 AHR (0.53) GRIA1CACNG8PDE3BPDE3AAHR
SCHEMBL21983115 0.60 AHR (0.53) GRIA1CACNG8PDE3BPDE3AAHR
SCHEMBL24191820 0.60 AHR (0.53) GRIA1CACNG8PDE3BPDE3AAHR
SCHEMBL25899777 0.60 AHR (0.53) GRIA1CACNG8PDE3BPDE3AAHR
SCHEMBL24192217 0.60 AHR (0.53) GRIA1CACNG8PDE3BPDE3AAHR
SCHEMBL7038460 0.60 AHR (0.57) GRIA1CACNG8PDE3BPDE3AAHR
SCHEMBL265219 0.60 AHR (0.53) GRIA1CACNG8PDE3BPDE3AAHR

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-20050143349-A1 Phosphorus containing compounds useful for the regulation of LDL and Lp(a) levels QUATRX PHARMACEUTICALS CO. 2005-06-30 US claimed
WO-2005058330-A1 PHOSPHORUS CONTAINING COMPOUNDS USEFUL FOR THE REGULATION OF LDL AND LP(A) LEVELS QUATRX PHARMACEUTICALS CO. (US) 2005-06-30 WO claimed
US-20050143349-A1 Phosphorus containing compounds useful for the regulation of LDL and Lp(a) levels QUATRX PHARMACEUTICALS CO. 2005-06-30 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-20050143349-A1 Phosphorus containing compounds useful for the regulation of LDL and Lp(a) levels APOB, LDLR, LPL GRIA1 2013/4885CACNG8 1709/4885PDE3B 1124/4885

“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.