SCHEMBL3158376

SCHEMBL3158376

Cc1ccc(C2=CC3CCC(C2)N3C(=O)N2CCCc3ccccc32)c(Cl)n1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 8/20 0.44
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 3/20 0.40
MAPK1 P28482 1/20 0.40
NOTUM Q6P988 1/20 0.39
PKM P14618 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
POLB P06746 1/20 0.39
AVPR1A P37288 1/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
RECQL P46063 1/20 0.38

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
SCHEMBL3158385 1.00 HSD11B1 (0.44) HSD11B1SMN1; SMN2ALDH1A1MAPK1NOTUM
SCHEMBL2071055 0.84 PDE4B (0.48) HSD11B1SMN1; SMN2MAPK1NOTUMNPSR1
SCHEMBL2071056 0.84 PDE4B (0.48) HSD11B1SMN1; SMN2MAPK1NOTUMNPSR1
SCHEMBL3151153 0.84 HSD11B1 (0.46) HSD11B1SMN1; SMN2ALDH1A1NOTUMPKM
SCHEMBL3151160 0.84 HSD11B1 (0.46) HSD11B1SMN1; SMN2ALDH1A1NOTUMPKM
SCHEMBL2070085 0.83 HSD11B1 (0.45) HSD11B1ALDH1A1NOTUMNPSR1POLB
SCHEMBL2070089 0.83 HSD11B1 (0.45) HSD11B1ALDH1A1NOTUMNPSR1POLB
SCHEMBL2073032 0.82 HSD11B1 (0.44) HSD11B1SMN1; SMN2ALDH1A1POLBKDM4E
SCHEMBL2073029 0.82 HSD11B1 (0.44) HSD11B1SMN1; SMN2ALDH1A1POLBKDM4E
SCHEMBL2072090 0.82 HSD11B1 (0.45) HSD11B1SMN1; SMN2NOTUMPOLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 2670/4885ALDH1A1 68/4885
US-20100324084-A1 UREA DERIVATIVES OF TROPANE, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION HSD11B1, ADRA1D, HSD17B1 HSD11B1 1/4885SMN1; SMN2 2670/4885ALDH1A1 68/4885

“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.