SCHEMBL3770358

SCHEMBL3770358

NC(=O)CCCC(=O)ON1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.47
ATM Q13315 1/20 0.38
CYP1A2 P05177 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TSHR P16473 1/20 0.32
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ALDH1A1 P00352 2/20 0.31
POLB P06746 1/20 0.31
GLA P06280 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
SCHEMBL5874669 0.92 ATM (0.43) L3MBTL1ATMCYP1A2MAPK1SMN1; SMN2
SCHEMBL14228809 0.90 ATM (0.44) L3MBTL1ATMCYP1A2MAPK1SMN1; SMN2
SCHEMBL5874399 0.88 L3MBTL1 (0.39) L3MBTL1ATMCYP1A2MAPK1SMN1; SMN2
SCHEMBL442464 0.86 L3MBTL1 (0.38) L3MBTL1ATMCYP1A2MAPK1SMN1; SMN2
SCHEMBL5874140 0.83 ALDH1A1 (0.38) L3MBTL1ATMCYP1A2MAPK1SMN1; SMN2
SCHEMBL4631225 0.81 KMT2A (0.41) L3MBTL1CYP1A2MAPTMEN1KMT2A
SCHEMBL5874880 0.81 L3MBTL1 (0.47) L3MBTL1CYP1A2MAPK1MAPTMEN1
SCHEMBL3443989 0.79 SMN1; SMN2 (0.58) L3MBTL1CYP1A2MAPK1SMN1; SMN2MAPT
SCHEMBL442463 0.79 CYP1A2 (0.48) CYP1A2MAPK1SMN1; SMN2TSHRMEN1
SCHEMBL5737549 0.79 L3MBTL1 (0.55) L3MBTL1MAPK1TSHRMAPTMEN1

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-8569313-B2 Meta-substituted phenyl sulfonyl amides of secondary amino acid amides, the production thereof, and use thereof as matriptase inhibitors THE MEDICINES COMPANY (LEIPZIG) GMBH (DE) 2013-10-29 US disclosed
US-20100305090-A1 META-SUBSTITUTED PHENYL SULFONYL AMIDES OF SECONDARY AMINO ACID AMIDES, THE PRODUCTION THEREOF, AND USE THEREOF AS MATRIPTASE INHIBITORS THE MEDICINES COMPANY (LEIPZIG) GMBH (DE) 2010-12-02 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-20100305090-A1 META-SUBSTITUTED PHENYL SULFONYL AMIDES OF SECONDARY AMINO ACID AMIDES, THE PRODUCTION THEREOF, AND USE THEREOF AS MATRIPTASE INHIBITORS MMP7, DNPEP, METAP1 L3MBTL1 2328/4885ATM 2553/4885CYP1A2 1899/4885

“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.