SCHEMBL3582949

SCHEMBL3582949

NCCCC(CNC1CCCCC1)NC=O

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 2/20 0.40
ERAP2 Q6P179 2/20 0.40
KDM4E B2RXH2 2/20 0.40
ADH1B P00325 2/20 0.35
ADH1C P00326 2/20 0.35
ADH1A P07327 2/20 0.35
ADH4 P08319 1/20 0.35
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ADH7 P40394 1/20 0.32
LMNA P02545 2/20 0.31
CPB2 Q96IY4 2/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
SCN1A P35498 1/20 0.30
SCN2A Q99250 1/20 0.30
SCN3A Q9NY46 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30

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
Formic Acid SCHEMBL3582950 0.76 ANPEP (0.46) ANPEPERAP2KDM4EADH1BADH1C
SCHEMBL14378849 0.74 ADH1B (0.34) ADH1BADH1CADH1AADH4ADH7
SCHEMBL3585774 0.66 KDM4E (0.50) ANPEPERAP2KDM4EHTTSMN1; SMN2
SCHEMBL9810147 0.66 KDM4E (0.50) ANPEPERAP2KDM4EHTTSMN1; SMN2
SCHEMBL28990566 0.66 ANPEP (0.38) ANPEPERAP2KDM4E
SCHEMBL21192378 0.66 ANPEP (0.38) ANPEPERAP2KDM4E
SCHEMBL9417530 0.65 CXCR4 (0.48) KDM4E
SCHEMBL10938415 0.65 CXCR4 (0.48) KDM4E
SCHEMBL10937094 0.65 CXCR4 (0.48) KDM4E
SCHEMBL27221 0.65 CXCR4 (0.48) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100048549-A1 Peptidomimetics selective for the somatostatin receptor subtypes 1 and/or 4 Wurster, Siegfried (FI) 2010-02-25 US disclosed
EP-1885693-A1 PEPTIDOMIMETICS SELECTIVE FOR THE SOMATOSTATIN RECEPTOR SUBTYPES 1 AND/OR 4 Wurster, Siegfried (FI) 2008-02-13 EP disclosed
WO-2006123020-A1 PEPTIDOMIMETICS SELECTIVE FOR THE SOMATOSTATIN RECEPTOR SUBTYPES 1 AND/OR 4 JUVANTIA PHARMA LTD OY (FI) 2006-11-23 WO 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-20100048549-A1 Peptidomimetics selective for the somatostatin receptor subtypes 1 and/or 4 SSTR1, SSTR4, SSTR3 ANPEP 200/4885ERAP2 1692/4885KDM4E 1818/4885

“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.