SCHEMBL4157978

SCHEMBL4157978

CS(=O)(=O)c1ccc(N)c(-c2ccc3[nH]c(=O)c4[nH]cc(CCC(=O)O)c4c3c2)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
PDGFRB P09619 4/20 0.38
FGFR1 P11362 4/20 0.38
KDR P35968 4/20 0.38
WEE1 P30291 1/20 0.36
IKBKB O14920 2/20 0.35
SPR P35270 1/20 0.34
GPR17 Q13304 1/20 0.32
S1PR1 P21453 3/20 0.32
APEX1 P27695 1/20 0.32
F7 P08709 1/20 0.32
EGFR P00533 3/20 0.32
GCGR P47871 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31
KDM4E B2RXH2 1/20 0.31
BRD4 O60885 1/20 0.31

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
SCHEMBL4155187 0.88 HPGD (0.38) HPGDCYP2C19PDGFRBFGFR1KDR
SCHEMBL4155339 0.85 CAMKK2 (0.40) HPGDCYP2C19PDGFRBFGFR1KDR
SCHEMBL3241482 0.84 WEE1 (0.39) HPGDCYP2C19WEE1BRD4
SCHEMBL4165826 0.84 HPGD (0.43) HPGDCYP2C19PDGFRBFGFR1KDR
SCHEMBL4153846 0.80 CAMKK2 (0.39) IKBKBSPRS1PR1F7
SCHEMBL4162915 0.80 PDGFRB (0.46) HPGDCYP2C19PDGFRBFGFR1KDR
SCHEMBL4162598 0.80 HPGD (0.52) HPGDCYP2C19PDGFRBFGFR1KDR
SCHEMBL3251688 0.80 JAK3 (0.39) CYP2C19WEE1KDM4E
SCHEMBL4155191 0.79 HPGD (0.42) HPGDCYP2C19PDGFRBFGFR1KDR
SCHEMBL4157488 0.79 MCL1 (0.42) PDGFRBFGFR1KDRIKBKBEGFR

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 HPGD 882/4885CYP2C19 4277/4885PDGFRB 582/4885

“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.