SCHEMBL4153950

SCHEMBL4153950

O=C(O)CCc1c[nH]c2c(=O)[nH]c3ccc(S(=O)(=O)Nc4ccc(O)cc4)cc3c12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.50
GAA P10253 1/20 0.50
AR P10275 1/20 0.50
PDE3A Q14432 2/20 0.42
GFER P55789 1/20 0.40
POLB P06746 4/20 0.40
ALDH1A1 P00352 2/20 0.39
NAPEPLD Q6IQ20 1/20 0.39
MAPT P10636 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
BRD4 O60885 2/20 0.39
BRAF P15056 1/20 0.38
STAT3 P40763 1/20 0.38
PARP1 P09874 1/20 0.38
KDM4E B2RXH2 1/20 0.38
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38

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
SCHEMBL4163279 0.93 PKM (0.48) PKMGAAARPDE3APOLB
SCHEMBL4157628 0.92 ALDH1A1 (0.50) PKMGAAARPDE3APOLB
SCHEMBL4161137 0.92 POLB (0.50) PKMGAAARPDE3APOLB
SCHEMBL4160229 0.92 BRD4 (0.46) PKMGAAARPDE3APOLB
SCHEMBL4162956 0.92 HPGD (0.44) PKMGAAARPDE3APOLB
SCHEMBL4155342 0.90 SIRT2 (0.41) PKMGAAARPDE3APOLB
SCHEMBL4163720 0.89 BRD4 (0.48) PKMGAAGFERPOLBALDH1A1
SCHEMBL4166792 0.88 PTGDR2 (0.41) PKMGAAARPDE3AGFER
SCHEMBL4167129 0.88 POLB (0.41) PKMGAAARPDE3APOLB
SCHEMBL4158099 0.87 BRD4 (0.54) PDE3ABRD4

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-8426437-B2 Pyrroloquinoline derivatives and their use as protein kinases inhibitors PIERRE FABRE MEDICAMENT (FR) 2013-04-23 US claimed
US-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors PIERRE FABRE MEDICAMENT (FR) 2009-02-12 US claimed
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 PKM 276/4885GAA 3035/4885AR 3401/4885

“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.