SCHEMBL4170111

SCHEMBL4170111

CN(c1cccc(Cl)c1)S(=O)(=O)c1ccc2[nH]c(=O)c3[nH]cc(CCC(=O)O)c3c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.41
USP2 O75604 1/20 0.41
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 1/20 0.40
ADRB2 P07550 1/20 0.40
RECQL P46063 1/20 0.40
KMT2A Q03164 1/20 0.40
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
GPR17 Q13304 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
SCHEMBL4166925 0.91 USP2 (0.45) HPGDHSD17B10ALDH1A1CYP3A4CYP2C9
SCHEMBL4162711 0.86 PTGDR2 (0.38) HPGDHSD17B10ALDH1A1CYP3A4CYP2C9
SCHEMBL4156375 0.85 HSD17B10 (0.54) HPGDHSD17B10ALDH1A1LMNAMAPT
SCHEMBL3247194 0.85 HPGD (0.48) HPGDHSD17B10ALDH1A1CYP3A4CYP2C9
SCHEMBL4162942 0.85 KDM4E (0.44) HPGDALDH1A1CYP2C9CYP2C19MAPT
SCHEMBL4162699 0.81 BRD4 (0.47) ALDH1A1LMNAMAPTMEN1KMT2A
SCHEMBL4157903 0.81 MAPT (0.48) HPGDHSD17B10ALDH1A1LMNAMAPT
SCHEMBL3250657 0.81 CRHBP (0.49) HPGDHSD17B10ALDH1A1CYP3A4CYP2C9
SCHEMBL4155191 0.81 HPGD (0.42) HPGDALDH1A1CYP2C19MAPTKDM4E
SCHEMBL4162755 0.80 ALDH1A1 (0.44) HPGDHSD17B10ALDH1A1LMNAMAPT

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 2 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 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 882/4885HSD17B10 3847/4885ALDH1A1 3830/4885

“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.