SCHEMBL3459488

SCHEMBL3459488

O=C(NCCCN1CCNCC1)N1CCOCC1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.57
LMNA P02545 2/20 0.55
GAA P10253 2/20 0.52
KDM4E B2RXH2 1/20 0.51
HPGD P15428 1/20 0.50
DUSP3 P51452 1/20 0.50
ALDH1A1 P00352 1/20 0.49
MAPK1 P28482 1/20 0.49
HIF1A Q16665 1/20 0.49
DRD2 P14416 2/20 0.48
DRD3 P35462 2/20 0.48
ADRA1A P35348 1/20 0.48
RAB9A P51151 1/20 0.48
BCHE P06276 1/20 0.46
PKM P14618 1/20 0.46
EPHX1 P07099 1/20 0.46

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
SCHEMBL4560028 0.83 GAA (0.60) HTTLMNAGAAKDM4EHPGD
SCHEMBL19884755 0.77 HTT (0.55) HTTLMNAGAAKDM4EHPGD
SCHEMBL14861110 0.76 HSD17B10 (0.49) LMNAGAAKDM4EALDH1A1RAB9A
SCHEMBL16083486 0.75 HSD17B10 (0.53) GAAKDM4EALDH1A1BCHE
SCHEMBL31483014 0.74 GAA (0.49) LMNAGAAKDM4EALDH1A1MAPK1
SCHEMBL8139296 0.74 MEN1 (0.49) HTTLMNAGAAKDM4EALDH1A1
SCHEMBL842103 0.74 HTT (0.68) HTTLMNAGAAKDM4EALDH1A1
SCHEMBL5020904 0.74 HTT (0.97) HTTLMNAALDH1A1MAPK1PKM
SCHEMBL3021250 0.74 LMNA (0.56) LMNAGAAKDM4EHPGDDUSP3
SCHEMBL17471147 0.74 LMNA (0.52) HTTLMNAGAAKDM4EHPGD

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
EP-2240447-A2 MORPHOLINE DERIVATES AS ANTIOBESITY AGENTS AstraZeneca AB (Publ) (SE) 2010-10-20 EP claimed
US-20090203695-A1 Compounds IV BIOVITRUM AB (SE) 2009-08-13 US claimed
WO-2009071678-A2 MORPHOLINE DERIVATIVES AS ANTIOBESITY AGENTS BIOVITRUM AB (PUBL) (SE) 2009-06-11 WO claimed
EP-2240447-A2 MORPHOLINE DERIVATES AS ANTIOBESITY AGENTS AstraZeneca AB (Publ) (SE) 2010-10-20 EP disclosed
US-20090203695-A1 Compounds IV BIOVITRUM AB (SE) 2009-08-13 US disclosed
WO-2009071678-A2 MORPHOLINE DERIVATIVES AS ANTIOBESITY AGENTS BIOVITRUM AB (PUBL) (SE) 2009-06-11 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-20090203695-A1 Compounds IV GPR119, FABP4, LIPC HTT 3886/4885LMNA 748/4885GAA 1049/4885

“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.