SCHEMBL15224299

SCHEMBL15224299

NCCCC(=O)NCC1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.54
EPHX1 P07099 2/20 0.50
HDAC3 O15379 1/20 0.50
HDAC4 P56524 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
HDAC9 Q9UKV0 1/20 0.50
HDAC5 Q9UQL6 1/20 0.50
GLA P06280 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
MMP1 P03956 1/20 0.47
MMP2 P08253 1/20 0.47

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
SCHEMBL15224107 0.89 CYP2D6 (0.58) CYP2D6EPHX1HDAC3HDAC4HDAC1
SCHEMBL8290227 0.84 GLA (0.57) CYP2D6EPHX1HDAC3HDAC4HDAC1
SCHEMBL11863514 0.84 EPHX1 (0.52) CYP2D6EPHX1HDAC3HDAC4HDAC1
SCHEMBL13519 0.82 FAAH (0.57) CYP2D6EPHX1HDAC3HDAC4HDAC1
SCHEMBL10702291 0.81 CYP2D6 (0.61) CYP2D6EPHX1SMN1; SMN2CA12CA1
SCHEMBL21096969 0.81 HDAC3 (0.52) CYP2D6EPHX1HDAC3HDAC4HDAC1
SCHEMBL8051690 0.81 HDAC3 (0.52) CYP2D6EPHX1HDAC3HDAC4HDAC1
SCHEMBL19227335 0.81 HDAC3 (0.52) CYP2D6EPHX1HDAC3HDAC4HDAC1
SCHEMBL27405108 0.81 FAAH (0.60) EPHX1HDAC3HDAC4HDAC1HDAC7
SCHEMBL30259898 0.80 FAAH (0.59) EPHX1HDAC3HDAC4HDAC1HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11572398-B2 GLP-1 derivatives and uses thereof NOVO NORDISK A/S (DK) 2023-02-07 US disclosed
US-20170320927-A1 GLP-1 Derivatives and Uses Thereof NOVO NORDISK A/S (DK) 2017-11-09 US disclosed
US-8822452-B2 Inhibitor compounds of 11-beta-hydroxysteroid dehydrogenase type 1 LABORATORIOS SALVAT, S.A. (ES) 2014-09-02 US disclosed
US-20130303522-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 LABORATORIOS SALVAT, S.A. (ES) 2013-11-14 US disclosed
US-8524894-B2 Inhibitor compounds of 11-beta-hydroxysteroid dehydrogenase type 1 LABORATORIOS SALVAT, S.A. (ES) 2013-09-03 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 (3 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-20130303522-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 CYP2D6 395/4885EPHX1 227/4885HDAC3 1439/4885
US-11572398-B2 GLP-1 derivatives and uses thereof GLP1R, GIPR, GCG CYP2D6 2531/4885EPHX1 2107/4885HDAC3 2643/4885
US-20170320927-A1 GLP-1 Derivatives and Uses Thereof GLP1R, GIPR, GCG CYP2D6 2531/4885EPHX1 2107/4885HDAC3 2643/4885

“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.