SCHEMBL2632475

SCHEMBL2632475

Cc1ccc2c([nH]c(=O)n2C(C)C)c1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
DAO P14920 4/20 0.42
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
B3GNT2 Q9NY97 1/20 0.36
PGR P06401 8/20 0.36
SLC22A12 Q96S37 1/20 0.36
HPD P32754 1/20 0.34
CYP3A4 P08684 1/20 0.33
CYP2B6 P20813 1/20 0.33

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
SCHEMBL2632476 0.85 POLB (0.40) POLBDAOKDM4EGAAPGR
SCHEMBL12730589 0.84 PGR (0.46) POLBDAOKDM4EGAAB3GNT2
SCHEMBL2632474 0.83 POLB (0.41) POLBDAOPGRHPD
SCHEMBL1655471 0.72 ATM (0.45) POLBDAOKDM4EGAAPGR
SCHEMBL10165987 0.72 EZH2 (0.37) POLBDAOKDM4EGAA
SCHEMBL12793467 0.71 DAO (0.42) POLBDAOKDM4EGAAB3GNT2
SCHEMBL27295279 0.69 POLB (0.68) POLBKDM4EGAAB3GNT2PGR
SCHEMBL31473364 0.69 POLB (0.68) POLBKDM4EGAAB3GNT2PGR
SCHEMBL806063 0.68 POLB (0.50) POLBDAOPGRCYP3A4CYP2B6
SCHEMBL1656819 0.68 POLB (0.50) POLBDAOPGR

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-20120101032-A1 NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2012-04-26 US disclosed
WO-2012054874-A1 NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2012-04-26 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-20120101032-A1 NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION EIF2AK2, HAVCR2, EIF4A2 POLB 399/4885DAO 2853/4885KDM4E 507/4885

“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.