SCHEMBL2638073

SCHEMBL2638073

CN(C)CCCNc1cccc(C(=O)O)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.51
▸ LMNA P02545 1/20 0.51
▸ RAD52 P43351 3/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ SLC2A1 P11166 1/20 0.47
▸ APOBEC3A P31941 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ APOBEC3G Q9HC16 1/20 0.47
▸ PIM2 Q9P1W9 1/20 0.47
▸ IRAK4 Q9NWZ3 1/20 0.46
▸ ALOX15 P16050 2/20 0.44
▸ TSHR P16473 1/20 0.44
▸ ACMSD Q8TDX5 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ LCK P06239 1/20 0.43
▸ TOP2A P11388 1/20 0.42
▸ APAF1 O14727 1/20 0.41
▸ CASP7 P55210 1/20 0.41

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
SCHEMBL2638289 0.91 KDM4E (0.54) KDM4ELMNAKMT2AALOX15TSHR
SCHEMBL2638590 0.85 KDM4E (0.53) KDM4ELMNARAD52POLBPIM2
SCHEMBL18167999 0.84 KDM4E (0.55) KDM4ELMNANPC1ALOX15TSHR
SCHEMBL2639071 0.82 KDM4E (0.56) KDM4ELMNARAD52POLBRAB9A
SCHEMBL18167973 0.80 KDM4E (0.58) KDM4ELMNAALOX15TSHRACMSD
SCHEMBL2638388 0.80 KDM4E (0.51) KDM4ELMNAPOLBKMT2APIM2
SCHEMBL24214261 0.77 KDM4E (0.48) KDM4ELMNAKMT2AALOX15TSHR
SCHEMBL19347397 0.77 KDM4E (0.67) KDM4ELMNAKMT2AALOX15TSHR
SCHEMBL2639455 0.77 KDM4E (0.54) KDM4ELMNAALOX15TSHRACMSD
SCHEMBL2638608 0.77 KDM4E (0.62) KDM4ELMNAKMT2APIM2ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2310356-B1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME LUNDBECK & CO AS H (DK) 2013-08-14 — — EP claimed
JP-2011529057-A — — 2011-12-01 — — JP claimed
WO-2010011570-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME H. LUNDBECK A/S (DK) 2010-01-28 — — WO claimed
US-20100022546-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME H. LUNDBECK A/S (DK) 2010-01-28 — — US claimed
US-8716284-B2 Adamantyl diamide derivatives and uses of same H. LUNDBECK A/S (DK) 2014-05-06 — — US disclosed
EP-2310356-B1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME LUNDBECK & CO AS H (DK) 2013-08-14 — — EP disclosed
US-20130184277-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME H. LUNDBECK A/S (DK) 2013-07-18 — — US disclosed
US-8389519-B2 Adamantyl diamide derivatives and uses of same H. LUNDBECK A/S (DK) 2013-03-05 — — US disclosed
US-20120270873-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME H. LUNDBECK A/S (DK) 2012-10-25 — — US disclosed
US-8198275-B2 Adamantyl diamide derivatives and uses of same H. LUNDBECK A/S (DK) 2012-06-12 — — US disclosed
US-20100022546-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME H. LUNDBECK A/S (DK) 2010-01-28 — — 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-20120270873-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME QDPR, PDE3B, ADM2 KDM4E 2855/4885LMNA 4417/4885RAD52 3963/4885
US-20130184277-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME QDPR, PDE3B, ADM2 KDM4E 2889/4885LMNA 4385/4885RAD52 3947/4885
US-20100022546-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME QDPR, ADM2, PDE3B KDM4E 2749/4885LMNA 4496/4885RAD52 4128/4885

“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.

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