SCHEMBL6616685

SCHEMBL6616685

C=CCN1C2CCCC1CC(=O)C2

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.48
LMNA P02545 1/20 0.38
ALDH1A1 P00352 1/20 0.38
OPRM1 P35372 3/20 0.36
OPRD1 P41143 3/20 0.36
CYP3A4 P08684 1/20 0.35
POLB P06746 1/20 0.34
SLC6A2 P23975 2/20 0.34
DRD3 P35462 1/20 0.34
CHRM1 P11229 1/20 0.34
SLC6A4 P31645 1/20 0.34
PRCP P42785 1/20 0.33

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
SCHEMBL4820734 0.92 OPRM1 (0.41) MAPK1ALDH1A1OPRM1OPRD1CYP3A4
SCHEMBL1574160 0.79 CYP3A4 (0.34) MAPK1ALDH1A1OPRM1OPRD1CYP3A4
SCHEMBL8715080 0.79 CYP3A4 (0.34) MAPK1ALDH1A1OPRM1OPRD1CYP3A4
SCHEMBL4667127 0.79 LMNA (0.40) LMNAALDH1A1OPRM1OPRD1SLC6A2
SCHEMBL11051916 0.79 LMNA (0.40) LMNAALDH1A1OPRM1OPRD1SLC6A2
SCHEMBL3411467 0.77 MAPK1 (0.48) MAPK1ALDH1A1
SCHEMBL6617342 0.69 MAPK1 (0.59) MAPK1LMNAALDH1A1CYP3A4POLB
SCHEMBL12902953 0.69 KMT2A (0.51) MAPK1LMNAALDH1A1
SCHEMBL911191 0.69 KMT2A (0.51) MAPK1LMNAALDH1A1
SCHEMBL15425873 0.69 KMT2A (0.51) MAPK1LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0944627-B1 8-AZABICYCLO 3.2.1]OCTANE-, 8-AZABICYCLO 3.2.1]OCT-6-ENE-, 9-AZABICYCLO 3.3.1]NONANE-, 9-AZA-3-OXABICYCLO 3.3.1]NONANE- AND 9-AZA-3-THIABICYCLO 3.3.1]NONANE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INSECTICIDES SYNGENTA LTD (GB) 2004-02-18 EP disclosed
US-20020061913-A1 Bicyclic amine derivatives SYNGENTA LIMITED (GB) 2002-05-23 US disclosed
US-6291474-B1 COMBATING AND CONTROLLING INSECT, ACARINE OR NEMATODE PESTS ZENECA LIMITED (GB) 2001-09-18 US disclosed
US-6177442-B1 INSECTICIDES; PESTICIDES; MITICIDES; NEMATOCIDES ZENECA LIMITED (GB) 2001-01-23 US disclosed
US-5968947-A INSECTICIDES, ACARICIDES, NEMATOCIDES ZENECA LIMITED (GB) 1999-10-19 US disclosed
EP-0944627-A1 8-AZABICYCLO 3.2.1]OCTANE-, 8-AZABICYCLO 3.2.1]OCT-6-ENE-, 9-AZABICYCLO 3.3.1]NONANE-, 9-AZA-3-OXABICYCLO 3.3.1]NONANE- AND 9-AZA-3-THIABICYCLO 3.3.1]NONANE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INSECTICIDES ZENECA LIMITED (GB) 1999-09-29 EP disclosed
WO-1998025924-A1 8-AZABICYCLO[3.2.1]OCTANE-, 8-AZABICYCLO[3.2.1]OCT-6-ENE-, 9-AZABICYCLO[3.3.1]NONANE-, 9-AZA-3-OXABICYCLO[3.3.1]NONANE- AND 9-AZA-3-THIABICYCLO[3.3.1]NONANE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INSECTICIDES ZENECA LIMITED (GB) 1998-06-18 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 (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-20020061913-A1 Bicyclic amine derivatives ADRA1D, TAAR1, ADRA1A MAPK1 2041/4885LMNA 2203/4885ALDH1A1 274/4885

“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.