SCHEMBL1346266

SCHEMBL1346266

O=C(O)N1CCC(=Cc2ccc(Br)c(F)c2)CC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 2/20 0.40
SRD5A2 P31213 10/20 0.40
EP300 Q09472 1/20 0.34
CASP3 P42574 1/20 0.33
USP14 P54578 1/20 0.33
UCHL5 Q9Y5K5 1/20 0.33
HDAC2 Q92769 1/20 0.33
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL15536839 0.83 SRD5A2 (0.40) SRD5A1SRD5A2
SCHEMBL11949140 0.81 LMNA (0.42) LMNA
SCHEMBL6394037 0.80 LMNA (0.44) SRD5A2LMNA
SCHEMBL5211605 0.80 HSD11B1 (0.49) SRD5A1SRD5A2
SCHEMBL14720788 0.79 SRD5A2 (0.48) SRD5A1SRD5A2
SCHEMBL19994676 0.79 SRD5A2 (0.48) SRD5A1SRD5A2LMNA
SCHEMBL1863164 0.79 CASP3 (0.47) SRD5A1SRD5A2CASP3USP14UCHL5
SCHEMBL23365279 0.76 SRD5A2 (0.39) SRD5A1SRD5A2
SCHEMBL1012253 0.75 MGAM (0.48) SRD5A1SRD5A2MGAMGAASI
SCHEMBL1346001 0.74 SLC6A4 (0.38) SRD5A1SRD5A2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130303786-A1 BENZYLPIPERIZINE COMPOUND DAINIPPON SUMITOMO PHARMA CO (JP) 2013-11-14 US disclosed
US-8557998-B2 Benzylpiperizine compound DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2013-10-15 US disclosed
US-20120259122-A1 BENZYLPIPERIZINE COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-10-11 US disclosed
US-8232405-B2 Benzylpiperizine compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-07-31 US disclosed
US-8063223-B2 Benzylpiperizine compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-11-22 US disclosed
US-20110118312-A1 BENZYLPIPERIZINE COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-05-19 US disclosed
EP-2239254-A1 BENZYLPIPERIZINE COMPOUND Dainippon Sumitomo Pharma Co., Ltd. (JP) 2010-10-13 EP disclosed
US-20100113792-A1 BENZYLPIPERIZINE COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-05-06 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 (4 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-20130303786-A1 BENZYLPIPERIZINE COMPOUND OPRM1, GRM1, CHRM1 SRD5A1 133/4885SRD5A2 372/4885EP300 408/4885
US-20100113792-A1 BENZYLPIPERIZINE COMPOUND OPRM1, GRM1, CHRM1 SRD5A1 133/4885SRD5A2 372/4885EP300 408/4885
US-20120259122-A1 BENZYLPIPERIZINE COMPOUND OPRM1, GRM1, CHRM1 SRD5A1 133/4885SRD5A2 372/4885EP300 408/4885
US-20110118312-A1 BENZYLPIPERIZINE COMPOUND OPRM1, GRM1, CHRM1 SRD5A1 133/4885SRD5A2 372/4885EP300 408/4885

“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.