SCHEMBL4460733

SCHEMBL4460733

c1c[nH]c(-c2ccc(C34CCCN(CC3)C4)cn2)c1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.33
KDM4C Q9H3R0 1/20 0.32
ACP1 P24666 1/20 0.32
CHEK1 O14757 1/20 0.32
ALOX5AP P20292 1/20 0.31
PBRM1 Q86U86 1/20 0.31

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
Oxalic Acid SCHEMBL5220445 0.93 KDR (0.38) KDRKDM4CACP1ALOX5AP
SCHEMBL1483313 0.81 ROCK1 (0.36)
SCHEMBL4463296 0.80 HSD11B1 (0.40)
Hydrochloric Acid SCHEMBL1484299 0.80 ROCK1 (0.35)
SCHEMBL1483304 0.80
Bromide SCHEMBL4471147 0.79 HSD11B1 (0.39)
SCHEMBL1483655 0.77
SCHEMBL5217419 0.77 CYP11B1 (0.38) PBRM1
SCHEMBL2678244 0.77 HSD11B1 (0.41)
SCHEMBL5215973 0.77 KDR (0.31) KDRKDM4CCHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7585974-B2 Derivatives of 5-(pyridin-3-yl)-1-azabicyclo[3.2.1]octane, their preparation and their therapeutic application SANOFI-AVENTIS (FR) 2009-09-08 US claimed
US-20070185137-A1 Derivatives of 5-(pyridin-3-yl)-1-azabicyclo[3.2.1]octane, their preparation and their therapeutic application SANOFI-AVENTIS (FR) 2007-08-09 US claimed
EP-1465893-B1 DERIVATIVES OF 5-(PYRIDIN-3-YL)-1-AZABICYCLO (3.2.1) OCTANE, THE PREPARATION THEREOF AND THE APPLICATION OF SAME IN THERAPEUTICS SANOFI AVENTIS (FR) 2007-02-28 EP claimed

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-20070185137-A1 Derivatives of 5-(pyridin-3-yl)-1-azabicyclo[3.2.1]octane, their preparation and their therapeutic application PAICS, CYC1, AADAC KDR 2658/4885KDM4C 923/4885ACP1 707/4885

“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.