SCHEMBL2880975

SCHEMBL2880975

COC(=O)CCN1CCN(c2ccc(N)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.54
MEN1 O00255 1/20 0.54
GFER P55789 3/20 0.54
GAA P10253 3/20 0.54
MAPT P10636 3/20 0.54
KDM4E B2RXH2 3/20 0.54
ALDH1A1 P00352 2/20 0.54
ADRA2C P18825 1/20 0.54
PTK2B Q14289 1/20 0.54
ESR2 Q92731 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
RAD52 P43351 1/20 0.54
CASP6 P55212 1/20 0.51
HTR1A P08908 2/20 0.51
HTR7 P34969 2/20 0.51
SOD1 P00441 1/20 0.49
LMNA P02545 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
CA1 P00915 1/20 0.47
CA2 P00918 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
SCHEMBL2876290 0.92 GFER (0.51) KMT2AMEN1GFERGAAMAPT
SCHEMBL28714705 0.89 DRD4 (0.49) KMT2AMEN1GFERGAAMAPT
SCHEMBL10260491 0.86 DRD2 (0.55) KMT2AMEN1GAAMAPTKDM4E
SCHEMBL22471168 0.85 GFER (0.57) KMT2AMEN1GFERGAAMAPT
SCHEMBL20562281 0.85 HTR1A (0.64) KMT2AGFERMAPTKDM4EALDH1A1
SCHEMBL12041657 0.83 MEN1 (0.52) KMT2AMEN1GFERGAAMAPT
SCHEMBL15650606 0.82 GFER (0.56) KMT2AMEN1GFERGAAMAPT
Hydrochloric Acid SCHEMBL8838061 0.82 HRH3 (0.53) KMT2AMEN1DRD2
SCHEMBL2882026 0.81 HTR1A (0.65) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL2876227 0.81 HTR1A (0.56) KMT2AMEN1MAPTKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7750012-B2 Biaryl nitrogen-heterocycle inhibitors of LTA4H for treating inflammation DECODE GENETICS EHF (IS) 2010-07-06 US disclosed
US-7750012-B2 Biaryl nitrogen-heterocycle inhibitors of LTA4H for treating inflammation DECODE GENETICS EHF (IS) 2010-07-06 US disclosed
US-7750012-B2 Biaryl nitrogen-heterocycle inhibitors of LTA4H for treating inflammation DECODE GENETICS EHF (IS) 2010-07-06 US disclosed
EP-1968961-A2 BIARYL NITROGEN HETEROCYCLE INHIBITORS OF LTA4H FOR TREATING INFLAMMATION Decode Genetics EHF (IS) 2008-09-17 EP disclosed
WO-2007078335-A2 BIARYL NITROGEN HETEROCYCLE INHIBITORS OF LTA4H FOR TREATING INFLAMMATION DECODE GENETICS, EHF. (IS) 2007-07-12 WO disclosed
WO-2007078335-A2 BIARYL NITROGEN HETEROCYCLE INHIBITORS OF LTA4H FOR TREATING INFLAMMATION DECODE GENETICS, EHF. (IS) 2007-07-12 WO disclosed
US-20070149544-A1 BIARYL NITROGEN-HETEROCYCLE INHIBITORS OF LTA4H FOR TREATING INFLAMMATION DECODE CHEMISTRY, INC. (US) 2007-06-28 US disclosed
US-20070149544-A1 BIARYL NITROGEN-HETEROCYCLE INHIBITORS OF LTA4H FOR TREATING INFLAMMATION DECODE CHEMISTRY, INC. (US) 2007-06-28 US disclosed
US-20070149544-A1 BIARYL NITROGEN-HETEROCYCLE INHIBITORS OF LTA4H FOR TREATING INFLAMMATION DECODE CHEMISTRY, INC. (US) 2007-06-28 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 (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-20070149544-A1 BIARYL NITROGEN-HETEROCYCLE INHIBITORS OF LTA4H FOR TREATING INFLAMMATION LTA4H, LTC4S, LTB4R KMT2A 3276/4885MEN1 4313/4885GFER 220/4885

“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.