SCHEMBL5556124

SCHEMBL5556124

CCc1c(CNC(C)=O)nn(C(C)C)c1Oc1cc(Cl)cc(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPAS1 Q99814 1/20 0.38
CARM1 Q86X55 1/20 0.37
PRMT6 Q96LA8 1/20 0.37
MALT1 Q9UDY8 1/20 0.33
SETDB1 Q15047 1/20 0.32
MAPT P10636 1/20 0.31
LTA4H P09960 1/20 0.31
P2RX7 Q99572 1/20 0.31
POLB P06746 1/20 0.30
RECQL P46063 1/20 0.30
PTGDR2 Q9Y5Y4 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
SCHEMBL5556274 0.90 CARM1 (0.39) CARM1PRMT6MALT1MAPTP2RX7
SCHEMBL5562003 0.90 CYP1A2 (0.38) MAPT
SCHEMBL14453990 0.89 MAPK8 (0.35) EPAS1CARM1PRMT6MALT1LTA4H
SCHEMBL5557512 0.85 PTGDR2 (0.33) CARM1PRMT6MAPTPOLBPTGDR2
SCHEMBL5562080 0.83 CARM1 (0.31) CARM1PRMT6
SCHEMBL5561735 0.83 MAPT (0.37) CARM1PRMT6MAPTPOLBRECQL
SCHEMBL5556006 0.83 PTGDR2 (0.41) CARM1PRMT6MAPTPOLBPTGDR2
SCHEMBL5560864 0.83 CYP1A2 (0.31) EPAS1CARM1PRMT6MAPTPOLB
SCHEMBL5560694 0.83 MALT1 (0.33) EPAS1CARM1PRMT6MALT1
SCHEMBL5562406 0.83 CARM1 (0.33) CARM1PRMT6MAPTP2RX7RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1597235-B1 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS HOFFMANN LA ROCHE (CH) 2007-08-15 EP disclosed
US-7241794-B2 Nonnucleoside reverse transcriptase inhibitors ROCHEPALO ALTO LLC (US) 2007-07-10 US disclosed
US-7241794-B2 Nonnucleoside reverse transcriptase inhibitors ROCHEPALO ALTO LLC (US) 2007-07-10 US disclosed
EP-1597235-A1 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2005-11-23 EP disclosed
US-20040192666-A1 Nonnucleoside reverse transcriptase inhibitors ROCHE PALO ALTO LLC 2004-09-30 US disclosed
WO-2004074257-A1 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2004-09-02 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-20040192666-A1 Nonnucleoside reverse transcriptase inhibitors POLRMT, RRM2B, RRM2 EPAS1 3601/4885CARM1 1063/4885PRMT6 425/4885

“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.