SCHEMBL2928035

SCHEMBL2928035

CCCN1CCN(c2ccc(O)c(S(C)(=O)=O)c2)CC1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 11/20 0.60
DRD3 P35462 5/20 0.48
SIGMAR1 Q99720 2/20 0.48
HTR6 P50406 1/20 0.46
DRD4 P21917 1/20 0.43
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
TMEM97 Q5BJF2 1/20 0.42

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
SCHEMBL2926891 0.92 DRD2 (0.51) DRD2DRD3HTR6DRD4KDM4E
SCHEMBL7430034 0.91 DRD2 (0.51) DRD2DRD3SIGMAR1HTR6
SCHEMBL2927674 0.84 DRD2 (0.60) DRD2DRD3SIGMAR1HTR6KDM4E
SCHEMBL2928872 0.82 DRD2 (0.57) DRD2DRD3SIGMAR1HTR6
SCHEMBL2921463 0.78 KDM4E (0.54) KDM4E
SCHEMBL21228554 0.76 DRD2 (0.61) DRD2DRD3SIGMAR1HTR6KDM4E
SCHEMBL29914707 0.76 DRD2 (0.61) DRD2DRD3SIGMAR1HTR6KDM4E
SCHEMBL3453749 0.75 DRD2 (1.00) DRD2DRD3SIGMAR1HTR6TMEM97
SCHEMBL2926804 0.74 DRD2 (0.51) DRD2DRD3KDM4EGAA
SCHEMBL13981461 0.74 DRD2 (0.60) DRD2DRD3SIGMAR1HTR6KDM4E

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-RE41315-E1 Modulators of dopamine neurotransmission NSAB, FILIAL AF NEUROSEARCH SWEDEN AB (DE) 2010-05-04 US disclosed
US-6924374-B2 Central nervous system disorders; psychological disorders A. CARLSSON RESEARCH AB (SE) 2005-08-02 US disclosed
EP-1419773-A2 4-Phenylpiperidine derivatives as modulators of dopamine neurotransmission A. Carlsson Research AB (SE) 2004-05-19 EP disclosed
US-20030004169-A1 Modulators of dopamine neurotransmission NSAB, FILIAL AF NEUROSEARCH SWEDEN AB, SVERIGE (DK) 2003-01-02 US disclosed
EP-1240143-A1 NEW MODULATORS OF DOPAMINE NEUROTRANSMISSION A. Carlsson Research AB (SE) 2002-09-18 EP disclosed
WO-2001046146-A1 NEW MODULATORS OF DOPAMINE NEUROTRANSMISSION A. CARLSSON RESEARCH AB (SE) 2001-06-28 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-20030004169-A1 Modulators of dopamine neurotransmission OPRD1, OPRK1, OPRM1 DRD2 16/4885DRD3 22/4885SIGMAR1 5/4885

“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.