SCHEMBL1738784

SCHEMBL1738784

CCN1CCN(c2ccccc2C=O)CC1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.51
DRD2 P14416 4/20 0.46
HRH3 Q9Y5N1 3/20 0.46
DRD3 P35462 2/20 0.46
HTR6 P50406 2/20 0.46
GAA P10253 2/20 0.44
MAPT P10636 2/20 0.44
RAD52 P43351 2/20 0.44
LMNA P02545 1/20 0.44
ALDH1A1 P00352 1/20 0.42
CYP2D6 P10635 1/20 0.42
ADRA1D P25100 1/20 0.42
ADRA1A P35348 1/20 0.42
ADRA1B P35368 1/20 0.42
KDM1A O60341 1/20 0.42
GFER P55789 1/20 0.42
KMT2A Q03164 1/20 0.42
CHRM1 P11229 1/20 0.41

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
SCHEMBL31158083 0.84 GAA (0.46) CHRNA7DRD2HRH3DRD3HTR6
SCHEMBL414216 0.81 ADRA2C (0.55) DRD2DRD3HTR6MAPTRAD52
SCHEMBL31376167 0.81 ADRA2C (0.55) DRD2DRD3HTR6MAPTRAD52
SCHEMBL2481062 0.81 MAPT (0.55) DRD2HRH3DRD3HTR6MAPT
SCHEMBL418557 0.81 DRD4 (0.57) DRD2DRD3MAPTALDH1A1
SCHEMBL5712285 0.81 HRH3 (0.45) HRH3GAAMAPTLMNAALDH1A1
SCHEMBL11027671 0.80 DRD2 (0.40) DRD2DRD3GAARAD52ALDH1A1
Hydrochloric Acid SCHEMBL5154521 0.79 ADRA2C (0.53) DRD2DRD3HTR6MAPTRAD52
SCHEMBL2556668 0.78 MAPT (0.62) CHRNA7GAAMAPTRAD52ALDH1A1
SCHEMBL1443718 0.78 HTT (0.51) HTR6MAPTLMNAALDH1A1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2978767-B1 DYEING METHOD USING A HAIR-DYEING PRECURSOR OBTAINED FROM IRIDOIDS, COMPOSITION, PRECURSOR AND DEVICE INCLUDING SAME OREAL (FR) 2018-10-03 EP disclosed
WO-2014154957-A1 DYEING METHOD USING A HAIR-DYEING PRECURSOR OBTAINED FROM IRIDOIDS, COMPOSITION, PRECURSOR AND DEVICE INCLUDING SAME L'OREAL (FR) 2014-10-02 WO disclosed
WO-2013045703-A1 DYE COMPOSITION COMPRISING A NON-GLYCOSYL IRIDOID COMPOUND AND A PARTICULAR ALDEHYDE OR IMINE, DYEING PROCESS AND DEVICE THEREFOR L'OREAL (FR) 2013-04-04 WO disclosed
EP-1727794-B1 NOVEL BENZYL(IDENE)-LACTAM DERIVATIVES PFIZER PROD INC (US) 2011-11-16 EP disclosed
US-20110263484-A1 SINGLE CHAIN FC TYPE III INTERFERONS AND METHODS OF USING SAME ZYMOGENETICS, INC. 2011-10-27 US disclosed
US-7479559-B2 3-[-2-(Piperazin-1-yl)benzyl]pyrrolidin-2-one derivatives; antidepressants, anxiolytic agents; obsessive compulsive disorder, psychological disorders, phobias; 5-HT1 agonist or antagonists; side effect reduction, in particular cardiac QTc prolongation; hydrogenation PFIZER INC. (US) 2009-01-20 US disclosed
CN-1934081-A Novel benayl(idene)-lactam derivatives PFIZER (US) 2007-03-21 CN disclosed
EP-1727794-A1 NOVEL BENZYL(IDENE)-LACTAM DERIVATIVES Pfizer Products Incorporated (US) 2006-12-06 EP disclosed
US-20050245521-A1 Novel benayl(idene)-lactam derivatives PFIZER INC. 2005-11-03 US disclosed
WO-2005090300-A1 NOVEL BENZYL(IDENE)-LACTAM DERIVATIVES PFIZER PRODUCTS INC. (US) 2005-09-29 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-20050245521-A1 Novel benayl(idene)-lactam derivatives HTR1E, HTR1D, HTR1A CHRNA7 76/4885DRD2 69/4885HRH3 1238/4885

“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.