SCHEMBL2070929

SCHEMBL2070929

O=C(N1CCCc2ccccc21)N1C2C=C(c3cccc(F)c3)CC1CC2

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.50
HSD11B1 P28845 1/20 0.44
POLB P06746 2/20 0.43
GAA P10253 1/20 0.42
HTT P42858 1/20 0.42
USP2 O75604 1/20 0.42
THRB P10828 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
ATM Q13315 1/20 0.41
ALDH1A1 P00352 3/20 0.40
RAB9A P51151 2/20 0.40
TSHR P16473 2/20 0.40
PKM P14618 1/20 0.40
NOTUM Q6P988 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PDE4D Q08499 2/20 0.39

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
SCHEMBL2070931 1.00 PDE4B (0.50) PDE4BHSD11B1POLBGAAHTT
SCHEMBL2071682 0.90 POLB (0.52) PDE4BHSD11B1POLBSMN1; SMN2ATM
SCHEMBL2071679 0.90 POLB (0.52) PDE4BHSD11B1POLBSMN1; SMN2ATM
SCHEMBL2072859 0.89 LMNA (0.47) HSD11B1POLBHTTSMN1; SMN2ALDH1A1
SCHEMBL3168844 0.89 LMNA (0.47) HSD11B1POLBHTTSMN1; SMN2ALDH1A1
SCHEMBL2072858 0.89 LMNA (0.47) HSD11B1POLBHTTSMN1; SMN2ALDH1A1
SCHEMBL2070475 0.86 USP30 (0.43) HSD11B1POLBUSP2SMN1; SMN2ALDH1A1
SCHEMBL2070472 0.86 USP30 (0.43) HSD11B1POLBUSP2SMN1; SMN2ALDH1A1
SCHEMBL2070964 0.85 POLB (0.46) HSD11B1POLBSMN1; SMN2ALDH1A1RAB9A
SCHEMBL2070962 0.85 POLB (0.46) HSD11B1POLBSMN1; SMN2ALDH1A1RAB9A

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
US-7897773-B2 Urea derivatives of tropane, their preparation and their therapeutic application SANOFI-AVENTIS (FR) 2011-03-01 US disclosed
US-20100324084-A1 UREA DERIVATIVES OF TROPANE, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI-AVENTIS (FR) 2010-12-23 US disclosed
EP-2046791-B1 UREA DERIVATIVES OF TROPANE, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI AVENTIS (FR) 2010-03-24 EP disclosed
US-20090170894-A1 UREA DERIVATIVES OF TROPANE, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI-AVENTIS (FR) 2009-07-02 US disclosed
EP-2046791-A2 UREA DERIVATIVES OF TROPANE, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION Sanofi-Aventis (FR) 2009-04-15 EP disclosed
WO-2008000951-A2 UREA DERIVATIVES OF TROPANE, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI-AVENTIS (FR) 2008-01-03 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 (2 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-20090170894-A1 UREA DERIVATIVES OF TROPANE, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION HSD11B1, ADRA1D, HSD17B1 PDE4B 287/4885HSD11B1 1/4885POLB 463/4885
US-20100324084-A1 UREA DERIVATIVES OF TROPANE, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION HSD11B1, ADRA1D, HSD17B1 PDE4B 287/4885HSD11B1 1/4885POLB 463/4885

“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.