SCHEMBL3256111

SCHEMBL3256111

CCCOC(=O)c1c[nH]c2c(=O)[nH]c3cc(F)c(S(=O)(=O)N(CCO)C(C)C)cc3c12

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
HSD17B10 Q99714 1/20 0.35
ALOX5AP P20292 2/20 0.33
FEN1 P39748 2/20 0.33
GABRA1 P14867 1/20 0.32
GABRB1 P18505 1/20 0.32
GABRA3 P34903 1/20 0.32
GABRB2 P47870 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
GRM1 Q13255 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TSHR P16473 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
SCHEMBL3253986 0.87 KDM4E (0.36) KDM4EHSD17B10GABRA1GABRB1GABRA3
SCHEMBL3253542 0.87 ALOX5AP (0.36) HSD17B10ALOX5APFEN1MEN1KMT2A
SCHEMBL3249777 0.87 ALOX5AP (0.33) ALOX5APFEN1
SCHEMBL3245661 0.85 KDM4E (0.34) KDM4EHSD17B10
SCHEMBL3246010 0.85 KDM4E (0.40) KDM4EHSD17B10GABRA1GABRB1GABRA3
SCHEMBL3251464 0.83 LMNA (0.36) KDM4EHSD17B10ALDH1A1TSHR
SCHEMBL3251461 0.79 KDM4E (0.33) KDM4EHSD17B10ALOX5APFEN1
SCHEMBL4165212 0.78 ALOX5AP (0.34) ALOX5APFEN1MEN1KMT2A
SCHEMBL3251666 0.77 KDM4E (0.37) KDM4EHSD17B10MEN1KMT2AALDH1A1
SCHEMBL3249689 0.77 KDM4E (0.42) KDM4EHSD17B10ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1899335-B1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PF MEDICAMENT (FR) 2010-05-19 EP claimed
US-8426437-B2 Pyrroloquinoline derivatives and their use as protein kinases inhibitors PIERRE FABRE MEDICAMENT (FR) 2013-04-23 US disclosed
US-8426437-B2 Pyrroloquinoline derivatives and their use as protein kinases inhibitors PIERRE FABRE MEDICAMENT (FR) 2013-04-23 US disclosed
US-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors PIERRE FABRE MEDICAMENT (FR) 2009-02-12 US disclosed
US-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors PIERRE FABRE MEDICAMENT (FR) 2009-02-12 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-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors MAP3K1, MAP3K2, MAP3K7 KDM4E 1970/4885HSD17B10 3847/4885ALOX5AP 2873/4885

“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.