SCHEMBL7104946

SCHEMBL7104946

NC(=O)CCCCCN1CCCCCC1=O

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 1/20 0.41
RAB9A P51151 4/20 0.41
GAA P10253 1/20 0.41
ALDH1A1 P00352 1/20 0.39
ADRA1B P35368 1/20 0.39
NPC1 O15118 2/20 0.39
ATM Q13315 1/20 0.38

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
SCHEMBL1520530 0.88 TSHR (0.58) TSHRL3MBTL1KMT2AMEN1
SCHEMBL9419439 0.88 KDM4E (0.43) TSHRL3MBTL1KMT2AMEN1RAB9A
SCHEMBL7103779 0.87 KMT2A (0.47) TSHRL3MBTL1KMT2AMEN1RAB9A
SCHEMBL4575280 0.86 TSHR (0.65) TSHRKMT2AMEN1RAB9AALDH1A1
SCHEMBL23347194 0.86 TSHR (0.45) TSHRL3MBTL1KMT2ARAB9AALDH1A1
Laurocapram SCHEMBL28259860 0.84 GAA (0.47) TSHRL3MBTL1KMT2AMEN1RAB9A
SCHEMBL19119048 0.83 GAA (0.43) TSHRL3MBTL1KMT2AMEN1RAB9A
SCHEMBL11670561 0.81 L3MBTL1 (0.44) TSHRL3MBTL1KMT2AMEN1RAB9A
SCHEMBL2633812 0.81 TSHR (0.67) TSHRL3MBTL1KMT2AMEN1RAB9A
Octadecanoic Acid Amide SCHEMBL28107856 0.80 TSHR (0.53) TSHRL3MBTL1KMT2AMEN1RAB9A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6660857-B2 Reuse of carpet wastes DSM N.V. (NL) 2003-12-09 US disclosed
EP-1257532-B1 PROCESS FOR THE PREPARATION OF $g(e)-CAPROLACTAM DSM IP ASSETS BV (NL) 2003-09-10 EP disclosed
US-20030065169-A1 Process for the preparation of epsilon-caprolactam DSM N.V. 2003-04-03 US disclosed
EP-1257532-A1 PROCESS FOR THE PREPARATION OF $g(e)-CAPROLACTAM DSM N.V. (NL) 2002-11-20 EP disclosed
WO-2001056984-A1 PROCESS FOR THE PREPARATION OF ε-CAPROLACTAM DSM N.V. (NL) 2001-08-09 WO disclosed
EP-1122241-A1 Process for the preparation of epsilon-caprolactam DSM N.V. (NL) 2001-08-08 EP 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-20030065169-A1 Process for the preparation of epsilon-caprolactam MCCC2, ACMSD, PCCA TSHR 445/4885L3MBTL1 4304/4885KMT2A 2947/4885

“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.