SCHEMBL4157628

SCHEMBL4157628

Cc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)c4[nH]cc(CCC(=O)O)c4c3c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
BRAF P15056 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPT P10636 7/20 0.45
POLB P06746 5/20 0.45
TP53 P04637 4/20 0.45
TDP1 Q9NUW8 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PKM P14618 3/20 0.45
GAA P10253 1/20 0.45
AR P10275 1/20 0.45
LMNA P02545 1/20 0.44
PDE3A Q14432 1/20 0.42
MAPK1 P28482 2/20 0.40
HSD17B10 Q99714 2/20 0.40
KDM4E B2RXH2 1/20 0.40
USP2 O75604 1/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40

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
SCHEMBL4155589 0.94 ALDH1A1 (0.50) ALDH1A1BRAFMEN1KMT2AMAPT
SCHEMBL4153950 0.92 PKM (0.50) ALDH1A1BRAFMAPTPOLBTDP1
SCHEMBL4163279 0.92 PKM (0.48) BRAFMAPTPOLBTP53TDP1
SCHEMBL4161137 0.91 POLB (0.50) ALDH1A1BRAFMEN1KMT2AMAPT
SCHEMBL4160229 0.91 BRD4 (0.46) ALDH1A1MAPTPOLBTDP1PKM
SCHEMBL4162956 0.91 HPGD (0.44) ALDH1A1BRAFMEN1KMT2AMAPT
SCHEMBL4162432 0.90 MAPT (0.47) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL4163720 0.90 BRD4 (0.48) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL4158056 0.89 MEN1 (0.56) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL4162500 0.89 PTGDR2 (0.45) ALDH1A1MAPTPOLBTP53LMNA

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 ALDH1A1 3830/4885BRAF 38/4885MEN1 3749/4885

“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.