SCHEMBL1138487

SCHEMBL1138487

OCC#CCN1CCN(Cc2ccccc2-c2ccc(F)cc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 11/20 0.48
TACR1 P25103 2/20 0.46
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
DRD3 P35462 1/20 0.43
HRH3 Q9Y5N1 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
ACHE P22303 1/20 0.41
MPO P05164 1/20 0.40
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL1138113 0.87 HTR7 (0.54) HTR7KDM4EALDH1A1GAAMAPT
SCHEMBL1138131 0.76 HTR7 (0.48) HTR7TACR1DRD2DRD4DRD3
SCHEMBL1138323 0.76 HTR7 (0.57) HTR7TACR1DRD2DRD4DRD3
SCHEMBL32667521 0.76 HTR7 (0.57) HTR7TACR1DRD2DRD4DRD3
SCHEMBL1111700 0.76 HTR7 (0.50) HTR7TACR1DRD2DRD4DRD3
SCHEMBL9951391 0.75 TACR1 (0.65) HTR7TACR1HRH3
SCHEMBL1540391 0.75 HTR7 (0.60) HTR7TACR1DRD2DRD4DRD3
SCHEMBL15938091 0.74 HTR7 (0.81) HTR7TACR1DRD2DRD4DRD3
SCHEMBL28230641 0.73 HTR7 (0.80) HTR7TACR1DRD2DRD4DRD3
SCHEMBL1138483 0.71 MEN1 (0.56) DRD2DRD3KDM4EALDH1A1ACHE

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
EP-1487810-B9 4-(DIARYLMETHYL)-1-PIPERAZINYL DERIVATIVES SUN PHARMA ADVANCED RES CO LTD (IN) 2011-02-23 EP disclosed
EP-1487810-B1 4-(DIARYLMETHYL)-1-PIPERAZINYL DERIVATIVES SUN PHARMA ADVANCED RES CO LTD (IN) 2010-02-17 EP disclosed
US-7297697-B2 with alkenyl moiety substituted at the 1-position of the piperazine unit; useful in the treatment of histamine mediated diseases SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2007-11-20 US disclosed
US-20050107393-A1 4-(diarylmethyl)-1-piperazinyl derivatives SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2005-05-19 US disclosed
EP-1487810-A2 4-(DIARYLMETHYL)-1-PIPERAZINYL DERIVATIVES Sun Pharmaceuticals Industries Ltd. (IN) 2004-12-22 EP disclosed
WO-2003079970-A2 4-(DIARYLMETHYL)-1-PIPERAZINYL DERIVATIVES SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2003-10-02 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-20050107393-A1 4-(diarylmethyl)-1-piperazinyl derivatives NPY2R, NPY1R, CBR3 HTR7 776/4885TACR1 194/4885DRD2 40/4885

“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.