SCHEMBL13636335

SCHEMBL13636335

CCC(C)N1CCN(C(=O)c2ccc(CN3CCOCC3)cc2)CC1

nearest known ligand 0.80

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 14/20 0.80
HPGD P15428 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.56
USP2 O75604 1/20 0.56
TSHR P16473 1/20 0.56
GAA P10253 1/20 0.55

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
Hydrochloric Acid SCHEMBL1177383 0.99 HRH3 (0.78) HRH3HPGDSMN1; SMN2USP2TSHR
SCHEMBL13636468 0.89 HRH3 (0.78) HRH3HPGDSMN1; SMN2USP2TSHR
SCHEMBL521532 0.89 HRH3 (1.00) HRH3HPGD
SCHEMBL1177199 0.89 HRH3 (0.79) HRH3HPGD
Hydrochloric Acid SCHEMBL1177422 0.88 HRH3 (0.76) HRH3HPGDSMN1; SMN2USP2TSHR
SCHEMBL1177345 0.88 HRH3 (0.79) HRH3HPGD
SCHEMBL1177462 0.88 HRH3 (0.79) HRH3HPGD
Hydrochloric Acid SCHEMBL1450562 0.88 HRH3 (0.97) HRH3HPGD
SCHEMBL1177241 0.87 HRH3 (0.71) HRH3HPGDSMN1; SMN2USP2TSHR
Succinic Acid SCHEMBL1177379 0.84 HRH3 (0.89) HRH3HPGD

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-2121636-B1 PROCESS FOR THE PREPARATION OF PIPERAZINYL AND DIAZEPANYL BENZAMIDE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2017-01-25 EP disclosed
EP-1558595-B1 PIPERAZINYL AND DIAZAPANYL BENZAMIDES AND BENZTHIOAMIDES JANSSEN PHARMACEUTICA NV (BE) 2009-11-25 EP disclosed
US-7414047-B2 Piperazinyl and diazapanyl benzamides and benzthioamides JANSSEN PHARMACEUTICA N.V. (BE) 2008-08-19 US disclosed
US-7414047-B2 Piperazinyl and diazapanyl benzamides and benzthioamides JANSSEN PHARMACEUTICA N.V. (BE) 2008-08-19 US disclosed
US-20080056991-A1 PIPERAZINYL AND DIAZAPANYL BENZAMIDES AND BENZTHIOAMIDES APODACA RICHARD L 2008-03-06 US disclosed
US-20080056991-A1 PIPERAZINYL AND DIAZAPANYL BENZAMIDES AND BENZTHIOAMIDES APODACA RICHARD L 2008-03-06 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-20080056991-A1 PIPERAZINYL AND DIAZAPANYL BENZAMIDES AND BENZTHIOAMIDES HRH2, HNMT, HRH3 HRH3 3/4885HPGD 384/4885SMN1; SMN2 2931/4885

“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.