SCHEMBL4158056

SCHEMBL4158056

CCOC(=O)c1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)c4[nH]cc(CCC(=O)O)c4c3c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.56
KMT2A Q03164 5/20 0.56
ALDH1A1 P00352 3/20 0.56
HPGD P15428 2/20 0.56
ALOX15 P16050 1/20 0.56
MAPK1 P28482 1/20 0.56
HSD17B10 Q99714 1/20 0.56
LMNA P02545 6/20 0.53
MAPT P10636 6/20 0.53
TP53 P04637 3/20 0.53
SMN1; SMN2 Q16637 5/20 0.47
NHERF1 O14745 1/20 0.46
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
THRB P10828 3/20 0.44
NPSR1 Q6W5P4 2/20 0.44
TSHR P16473 1/20 0.44

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
SCHEMBL4157628 0.89 ALDH1A1 (0.50) MEN1KMT2AALDH1A1HPGDALOX15
SCHEMBL3248371 0.87 MEN1 (0.59) MEN1KMT2AALDH1A1HPGDALOX15
SCHEMBL4163720 0.87 BRD4 (0.48) MEN1KMT2AALDH1A1HPGDMAPK1
SCHEMBL3251351 0.87 MEN1 (0.61) MEN1KMT2AALDH1A1HPGDALOX15
SCHEMBL4153950 0.86 PKM (0.50) ALDH1A1MAPTKDM4EPOLBTDP1
SCHEMBL4163279 0.86 PKM (0.48) MAPTTP53SMN1; SMN2POLBTDP1
SCHEMBL4162956 0.86 HPGD (0.44) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL4161137 0.86 POLB (0.50) MEN1KMT2AALDH1A1MAPTPOLB
SCHEMBL4160229 0.86 BRD4 (0.46) ALDH1A1MAPTPOLBTDP1GAA
SCHEMBL4162383 0.84 MAPT (0.46) MEN1KMT2AALDH1A1HPGDLMNA

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 MEN1 3749/4885KMT2A 1882/4885ALDH1A1 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.