SCHEMBL2070282

SCHEMBL2070282

O=C(N1CCCc2ccccc21)N1C2C=C(c3cccc4ccccc34)CC1CC2

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 6/20 0.45
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 1/20 0.42
NOTUM Q6P988 1/20 0.40
LMNA P02545 2/20 0.40
TSHR P16473 2/20 0.40
ALDH1A1 P00352 1/20 0.40
SIGMAR1 Q99720 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
RECQL P46063 1/20 0.39
SMO Q99835 1/20 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
SCHEMBL2070280 1.00 HSD11B1 (0.45) HSD11B1SMN1; SMN2POLBNOTUMLMNA
SCHEMBL2071564 0.90 HSD11B1 (0.45) HSD11B1SMN1; SMN2POLBNOTUMTSHR
SCHEMBL2071567 0.90 HSD11B1 (0.45) HSD11B1SMN1; SMN2POLBNOTUMTSHR
SCHEMBL2070949 0.89 HSD11B1 (0.44) HSD11B1SMN1; SMN2POLBLMNAALDH1A1
SCHEMBL2070946 0.89 HSD11B1 (0.44) HSD11B1SMN1; SMN2POLBLMNAALDH1A1
SCHEMBL2070915 0.87 HSD11B1 (0.45) HSD11B1SMN1; SMN2POLBLMNATSHR
SCHEMBL2070916 0.87 HSD11B1 (0.45) HSD11B1SMN1; SMN2POLBLMNATSHR
SCHEMBL2071535 0.86 HSD11B1 (0.42) HSD11B1SMN1; SMN2POLBNOTUMLMNA
SCHEMBL2071128 0.86 HSD11B1 (0.44) HSD11B1SMN1; SMN2POLBNOTUMLMNA
SCHEMBL2071533 0.86 HSD11B1 (0.42) HSD11B1SMN1; SMN2POLBNOTUMLMNA

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 HSD11B1 1/4885SMN1; SMN2 2670/4885POLB 463/4885
US-20100324084-A1 UREA DERIVATIVES OF TROPANE, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION HSD11B1, ADRA1D, HSD17B1 HSD11B1 1/4885SMN1; SMN2 2670/4885POLB 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.