SCHEMBL5175264

SCHEMBL5175264

CCOC(=O)C1CCCN(C2CCNCC2)C1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
ALDH1A1 P00352 10/20 0.52
POLB P06746 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HTT P42858 1/20 0.48
KDM4E B2RXH2 1/20 0.47
RAB9A P51151 1/20 0.47
LMNA P02545 1/20 0.46
CYP2C19 P33261 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
Hydrochloric Acid SCHEMBL6183891 0.99 MEN1 (0.54) MEN1KMT2AALDH1A1POLBSMN1; SMN2
Hydrochloric Acid SCHEMBL6183804 0.99 MEN1 (0.54) MEN1KMT2AALDH1A1POLBSMN1; SMN2
SCHEMBL6183815 0.92 ALDH1A1 (0.50) MEN1KMT2AALDH1A1POLBSMN1; SMN2
SCHEMBL6640195 0.92 ALDH1A1 (0.50) MEN1KMT2AALDH1A1POLBSMN1; SMN2
SCHEMBL12881570 0.84 ALDH1A1 (0.61) MEN1KMT2AALDH1A1POLBSMN1; SMN2
SCHEMBL2658539 0.84 MAPT (0.53) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL3552981 0.83 MEN1 (0.55) MEN1KMT2AALDH1A1POLBSMN1; SMN2
Hydrochloric Acid SCHEMBL5026735 0.82 MAPT (0.51) MEN1KMT2AALDH1A1POLBSMN1; SMN2
SCHEMBL11490414 0.81 ALDH1A1 (0.55) MEN1KMT2AALDH1A1POLBSMN1; SMN2
SCHEMBL372350 0.81 ALDH1A1 (0.55) MEN1KMT2AALDH1A1POLBSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1868605-A2 PHENYL AND PYRIDYL LTA4H MODULATORS Janssen Pharmaceutica, N.V. (BE) 2007-12-26 EP disclosed
WO-2006105304-A2 PHENYL AND PYRIDYL LTA4H MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2006-10-05 WO disclosed
US-20060223792-A1 Phenyl and pyridyl LTA4H modulators JANSSEN PHARMACEUTICA N.V. (BE) 2006-10-05 US disclosed
US-20060194811-A1 Pyrimidine derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-08-31 US disclosed
US-20060161004-A1 Novel compounds GLAXOSMITHKLINE SPA 2006-07-20 US disclosed
EP-1595869-A1 PYRIMIDINE DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 2005-11-16 EP disclosed
US-20050070574-A1 Novel compounds GLAXOSMITHKLINE SPA AND LABORATOIRE 2005-03-31 US disclosed
US-20040102633-A1 Novel compounds GLAXOSMITHKLINE S.P.A. (IT) 2004-05-27 US disclosed
EP-1339691-A1 NOVEL COMPOUNDS GlaxoSmithKline S.p.A. (IT) 2003-09-03 EP disclosed
WO-2002044154-A1 NOVEL COMPOUNDS GLAXOSMITHKLINE SPA (IT) 2002-06-06 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 (5 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-20050070574-A1 Novel compounds NR1H3, NR1H2, CNR1 MEN1 3329/4885KMT2A 3392/4885ALDH1A1 2641/4885
US-20060223792-A1 Phenyl and pyridyl LTA4H modulators LTA4H, LTB4R, LTC4S MEN1 4858/4885KMT2A 3196/4885ALDH1A1 1142/4885
US-20060161004-A1 Novel compounds SLC10A1, ABCB11, AQP1 MEN1 318/4885KMT2A 4394/4885ALDH1A1 1265/4885
US-20060194811-A1 Pyrimidine derivatives ADORA3, NR4A1, NR0B1 MEN1 2884/4885KMT2A 2616/4885ALDH1A1 1991/4885
US-20040102633-A1 Novel compounds H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CBR1, NR1H3 MEN1 3121/4885KMT2A 4037/4885ALDH1A1 2127/4885

“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.