SCHEMBL4160299

SCHEMBL4160299

NC(=O)C1CCCN(S(=O)(=O)c2ccc3[nH]c(=O)c4[nH]cc(CCCC(=O)O)c4c3c2)C1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.42
KMT2A Q03164 6/20 0.42
PKM P14618 1/20 0.42
AKR1C3 P42330 3/20 0.38
RXFP1 Q9HBX9 5/20 0.38
TP53 P04637 2/20 0.37
GAA P10253 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL3249354 0.85 KDM4E (0.45) MEN1KMT2AAKR1C3RXFP1GAA
SCHEMBL3251453 0.83 RXFP1 (0.43) MEN1KMT2AAKR1C3RXFP1POLB
Hydrochloric Acid SCHEMBL4163611 0.83 KDM4E (0.39) MEN1KMT2APKMRXFP1GAA
SCHEMBL4170125 0.83 KDM4E (0.47) MEN1KMT2APKMRXFP1GAA
Butyric Acid SCHEMBL4160300 0.80 MEN1 (0.45) MEN1KMT2ARXFP1TP53GAA
SCHEMBL4161880 0.79 BRD4 (0.43) MEN1KMT2AGAA
SCHEMBL3254812 0.79 MEN1 (0.42) MEN1KMT2ARXFP1TP53POLB
SCHEMBL4159941 0.78 JAK2 (0.38) MEN1KMT2AGAAPOLB
SCHEMBL3248958 0.78 MEN1 (0.43) MEN1KMT2ARXFP1TP53GAA
SCHEMBL4162757 0.78 CASP3 (0.37) MEN1KMT2APKMGAAPOLB

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 1882/4885PKM 276/4885

“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.