SCHEMBL3249920

SCHEMBL3249920

CCOC(=O)c1c[nH]c2c(=O)[nH]c3ccc(S(=O)(=O)Cc4ccccc4)cc3c12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.47
GABRB2 P47870 3/20 0.47
GABRB1 P18505 2/20 0.47
GABRA3 P34903 2/20 0.47
KDM4E B2RXH2 2/20 0.42
CLEC4M Q9H2X3 1/20 0.41
CDK5 Q00535 3/20 0.40
CDK5R1 Q15078 3/20 0.40
DAO P14920 1/20 0.40
FEN1 P39748 1/20 0.40
CSF1R P07333 1/20 0.40
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
TUBB4A P04350 1/20 0.39
TUBB P07437 1/20 0.39
TUBA3C P0DPH7 1/20 0.39
TUBA1B P68363 1/20 0.39
TUBA4A P68366 1/20 0.39
TUBB4B P68371 1/20 0.39
TUBB3 Q13509 1/20 0.39

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
SCHEMBL3252578 0.91 GABRA1 (0.41) GABRA1GABRB2GABRB1GABRA3KDM4E
SCHEMBL3247788 0.87 DAO (0.46) KDM4EDAOFEN1MAPTMEN1
SCHEMBL3249084 0.87 JAK2 (0.39) GABRA1GABRB2GABRB1GABRA3KDM4E
SCHEMBL3253410 0.86 MET (0.42) GABRA1GABRB2GABRB1GABRA3KDM4E
SCHEMBL3254915 0.86 MAPT (0.47) GABRA1GABRB2GABRB1GABRA3KDM4E
SCHEMBL3254539 0.85 MAPT (0.48) KDM4EMAPTMEN1POLBKMT2A
SCHEMBL3255978 0.85 FEN1 (0.39) GABRA1GABRB2GABRB1GABRA3KDM4E
SCHEMBL3242035 0.85 GABRA1 (0.45) GABRA1GABRB2GABRB1GABRA3KDM4E
SCHEMBL3251557 0.85 BRD4 (0.55) GABRA1GABRB2GABRB1GABRA3KDM4E
SCHEMBL3244720 0.84 GABRA1 (0.44) GABRA1GABRB2GABRB1GABRA3KDM4E

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
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

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 GABRA1 3395/4885GABRB2 2245/4885GABRB1 2360/4885

“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.