SCHEMBL5470993

SCHEMBL5470993

CCN1CCN(c2ccccc2O)CC1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
DRD4 P21917 1/20 0.56
CHRNA7 P36544 1/20 0.56
HTT P42858 1/20 0.54
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
RAD52 P43351 1/20 0.50
ALDH1A1 P00352 1/20 0.50
HTR7 P34969 1/20 0.49
DRD2 P14416 1/20 0.49
DRD3 P35462 1/20 0.49
ADRA1B P35368 1/20 0.49
HTR1A P08908 4/20 0.48

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
SCHEMBL4019882 0.84 GAA (0.70) GAASMN1; SMN2DRD4HTTLMNA
SCHEMBL11120307 0.84 GAA (0.70) GAASMN1; SMN2DRD4HTTLMNA
SCHEMBL12126914 0.79 GAA (0.58) GAASMN1; SMN2CHRNA7HTTLMNA
SCHEMBL9565835 0.79 KDM4E (0.66) DRD4CHRNA7LMNAALDH1A1DRD2
SCHEMBL8138271 0.79 DRD4 (0.62) GAADRD4LMNAMAPTALDH1A1
SCHEMBL1308333 0.79 ADRA2C (0.60) GAASMN1; SMN2DRD4HTTLMNA
SCHEMBL17764863 0.78 ADRA2C (0.65) GAASMN1; SMN2CHRNA7LMNAMAPT
SCHEMBL8044642 0.78 KDM4E (0.65) GAASMN1; SMN2DRD4CHRNA7ALDH1A1
SCHEMBL8375058 0.77 ADRA1B (0.59) GAADRD4HTTHTR7DRD2
SCHEMBL11096500 0.76 CHRNA7 (0.59) SMN1; SMN2DRD4CHRNA7DRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150011566-A1 N-PHENYLPIPERAZINE DERIVATIVES THAT ARE ANTAGONISTS OF A1A, A1D ADRENOCEPTORS AND 5-HT1A RECEPTORS FOR THE TREATMENT OF BENIGN PROSTATE HYPERPLASIA, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME UNIAO BRASILIENSE DE EDUCACAO E CULTURA - UBEC (BR) 2015-01-08 US disclosed
US-20150011566-A1 N-PHENYLPIPERAZINE DERIVATIVES THAT ARE ANTAGONISTS OF A1A, A1D ADRENOCEPTORS AND 5-HT1A RECEPTORS FOR THE TREATMENT OF BENIGN PROSTATE HYPERPLASIA, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME UNIAO BRASILIENSE DE EDUCACAO E CULTURA - UBEC (BR) 2015-01-08 US disclosed
EP-2810938-A1 N-PHENYLPIPERAZINE DERIVATIVES THAT ARE ANTAGONISTS OF A1A, A1D ADRENOCEPTORS AND 5-HT1A RECEPTORS FOR THE TREATMENT OF BENIGN PROSTATE HYPERPLASIA, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME Universidade Federal Do Rio De Janeiro - UFRJ (BR) 2014-12-10 EP disclosed
US-20070218002-A1 Method for Detecting Alzheimer's Disease and other Forms of Dementia, and Measuring Their Progression ENERGY, UNITED STATES DEPARTMENT OF 2007-09-20 US 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-20150011566-A1 N-PHENYLPIPERAZINE DERIVATIVES THAT ARE ANTAGONISTS OF A1A, A1D ADRENOCEPTORS AND 5-HT1A RECEPTORS FOR THE TREATMENT OF BENIGN PROSTATE HYPERPLASIA, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME ADRA1D, ADRA1A, ADRA1B GAA 4130/4885SMN1; SMN2 3574/4885DRD4 47/4885

“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.