SCHEMBL4496754

SCHEMBL4496754

CN1CCN(CCOC2=CC[CH]C=C2)CC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.44
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
HPGD P15428 2/20 0.37
USP2 O75604 1/20 0.37
HRH3 Q9Y5N1 3/20 0.37
HTR1B P28222 1/20 0.36
ABCB1 P08183 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
DRD3 P35462 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
POLB P06746 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL5253017 0.87 PSMB1 (0.45) LTA4HHRH3POLB
SCHEMBL5108436 0.86 PSMB1 (0.47) LTA4HHRH3DRD3POLB
SCHEMBL5111202 0.86 PSMB1 (0.47) LTA4HHRH3DRD3POLB
SCHEMBL7442447 0.78 MEN1 (0.46) MEN1KMT2AALDH1A1KDM4EHRH3
SCHEMBL5214714 0.75 ALDH1A1 (0.35) ALDH1A1KDM4E
SCHEMBL7603559 0.73 TSHR (0.33) LTA4HMEN1KMT2AALDH1A1KDM4E
SCHEMBL5252355 0.73
SCHEMBL14434276 0.73 LTA4H (0.40) LTA4HMEN1KMT2AALDH1A1KDM4E
SCHEMBL467600 0.71 MC4R (0.43) ALDH1A1KDM4E
SCHEMBL5116169 0.71 ALDH1A1 (0.33) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7504396-B2 Substituted heterocyclic compounds and methods of use AMGEN INC. (US) 2009-03-17 US disclosed
US-20050209221-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2005-09-22 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-20050209221-A1 Substituted heterocyclic compounds and methods of use ICOS, CD4, HLA-DRB1 LTA4H 1694/4885MEN1 134/4885KMT2A 2883/4885

“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.