SCHEMBL2024065

SCHEMBL2024065

CCCN(C(=O)Cc1cccs1)C1CCc2cccc(OC)c2C1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.59
DRD3 P35462 2/20 0.48
DRD4 P21917 1/20 0.48
CHRM2 P08172 1/20 0.48
CHRM1 P11229 1/20 0.48
CHRM3 P20309 1/20 0.48
HTR1D P28221 1/20 0.46

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
SCHEMBL2025141 1.00 DRD2 (0.59) DRD2DRD3DRD4CHRM2CHRM1
SCHEMBL2024495 1.00 DRD2 (0.59) DRD2DRD3DRD4CHRM2CHRM1
SCHEMBL21244081 0.93 DRD2 (0.68) DRD2DRD3DRD4CHRM1
SCHEMBL7704484 0.93 DRD2 (0.68) DRD2DRD3DRD4CHRM1
SCHEMBL2022338 0.84 DRD2 (0.56) DRD2DRD3DRD4CHRM2CHRM1
SCHEMBL21244084 0.82 DRD2 (0.67) DRD2DRD3DRD4CHRM1
SCHEMBL21244085 0.82 DRD2 (0.67) DRD2DRD3DRD4CHRM1
SCHEMBL2023950 0.82 DRD2 (0.57) DRD2DRD3DRD4CHRM2CHRM1
SCHEMBL2022304 0.81 DRD2 (0.51) DRD2DRD3DRD4CHRM2CHRM1
SCHEMBL2020786 0.80 DRD2 (0.74) DRD2DRD3DRD4CHRM1HTR1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2516383-B1 NEW AMINOTETRALINE DERIVATIVES GMEINER PETER (DE) 2017-05-03 EP disclosed
US-8691839-B2 Aminotetraline derivatives GMEINER PETER (DE) 2014-04-08 US disclosed
US-20130331429-A1 AMINOTETRALINE DERIVATIVES GMEINER PETER (DE) 2013-12-12 US disclosed
US-8586603-B2 Aminotetraline derivatives GMEINER PETER (DE) 2013-11-19 US disclosed
US-20120277262-A1 NEW AMINOTETRALINE DERIVATIVES GMEINER PETER (DE) 2012-11-01 US disclosed
EP-2516383-A1 NEW AMINOTETRALINE DERIVATIVES Gmeiner, Peter (DE) 2012-10-31 EP disclosed
WO-2011076708-A1 NEW AMINOTETRALINE DERIVATIVES GMEINER PETER (DE) 2011-06-30 WO disclosed
EP-2338873-A1 New aminotetraline derivatives Gmeiner, Peter (DE) 2011-06-29 EP 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-20120277262-A1 NEW AMINOTETRALINE DERIVATIVES AADAT, ABAT, AANAT DRD2 946/4885DRD3 1150/4885DRD4 1001/4885
US-20130331429-A1 AMINOTETRALINE DERIVATIVES AADAT, ABAT, SLC1A2 DRD2 415/4885DRD3 673/4885DRD4 562/4885

“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.