SCHEMBL6428532

SCHEMBL6428532

COc1c(C(=O)NCc2ccncc2)ccc2[nH]nc(/C=C/c3ccc(F)cc3)c12

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
CYP3A4 P08684 1/20 0.41
MAPK14 Q16539 1/20 0.41
CCR1 P32246 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAPT P10636 2/20 0.40
THRB P10828 2/20 0.40
MAPK1 P28482 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
LMNA P02545 3/20 0.38
TP53 P04637 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HSD17B10 Q99714 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL4152203 0.94 MAPT (0.45) POLBL3MBTL1MAPTTHRBMAPK1
SCHEMBL4152208 0.94 MAPT (0.45) POLBL3MBTL1MAPTTHRBMAPK1
SCHEMBL4148835 0.92 TP53 (0.46) POLBL3MBTL1MAPTTHRBMAPK1
SCHEMBL4148832 0.92 TP53 (0.46) POLBL3MBTL1MAPTTHRBMAPK1
SCHEMBL6428652 0.91 SMN1; SMN2 (0.44) POLBMAPK1SMN1; SMN2LMNAKDM4E
SCHEMBL4156427 0.91 MAPT (0.51) POLBMAPTTHRBMAPK1LMNA
SCHEMBL4156431 0.91 MAPT (0.51) POLBMAPTTHRBMAPK1LMNA
SCHEMBL4149303 0.91 PSEN1 (0.43) POLBMAPTTHRBLMNATP53
SCHEMBL4149306 0.91 PSEN1 (0.43) POLBMAPTTHRBLMNATP53
SCHEMBL6428413 0.90 THRB (0.46) POLBCYP3A4L3MBTL1THRBSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050074668-A1 Perfluorinated amide salts and their uses as ionic conducting materials MICHOT CHRISTOPHE (FR) 2005-04-07 US disclosed
US-20030052310-A1 Perfluorinated amide salts and their uses as ionic conducting materials MICHOT CHRISTOPHE (FR) 2003-03-20 US disclosed
US-20020009650-A1 Perfluorinated amide salts and their uses as ionic conducting materials MICHOT CHRISTOPHE (FR) 2002-01-24 US disclosed
US-6319428-B1 Perfluorinated amide salts and their uses as ionic conducting materials HYDRO-QUEBEC (CA) 2001-11-20 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 (2 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-20020009650-A1 Perfluorinated amide salts and their uses as ionic conducting materials AFF4, NHERF1, AFF2 POLB 2282/4885CYP3A4 367/4885MAPK14 1915/4885
US-20050074668-A1 Perfluorinated amide salts and their uses as ionic conducting materials AFF4, AFF2, AFF1 POLB 1773/4885CYP3A4 1566/4885MAPK14 2681/4885

“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.