SCHEMBL2525815

SCHEMBL2525815

CN(C)C(=O)C(CCN1CCC(c2ccccc2)(c2nn[nH]n2)CC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 16/20 0.57
DRD4 P21917 7/20 0.57
DRD3 P35462 7/20 0.57
DRD2 P14416 6/20 0.57
KMT2A Q03164 6/20 0.57
ADRA2A P08913 3/20 0.57
SLC6A4 P31645 3/20 0.57
MEN1 O00255 2/20 0.57
LMNA P02545 2/20 0.57
ADRB2 P07550 2/20 0.57
OPRD1 P41143 2/20 0.57
OPRK1 P41145 2/20 0.57
HTR2B P41595 2/20 0.57
SLC6A3 Q01959 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
SIGMAR1 Q99720 2/20 0.57
SCN1A P35498 2/20 0.57
SCN2A Q99250 2/20 0.57
SCN3A Q9NY46 2/20 0.57
HRH2 P25021 2/20 0.57

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
SCHEMBL12216179 0.89 KMT2A (0.54) OPRM1DRD4DRD3DRD2KMT2A
SCHEMBL12265221 0.86 OPRM1 (0.58) OPRM1DRD4DRD3DRD2KMT2A
SCHEMBL12216076 0.86 OPRM1 (0.56) OPRM1DRD4DRD3DRD2KMT2A
SCHEMBL12216162 0.81 OPRM1 (0.54) OPRM1DRD4DRD3DRD2KMT2A
SCHEMBL12265229 0.81 OPRM1 (0.54) OPRM1DRD4DRD3DRD2KMT2A
SCHEMBL2527593 0.81 OPRM1 (0.53) OPRM1DRD4DRD3DRD2KMT2A
SCHEMBL12216070 0.81 OPRM1 (0.53) OPRM1DRD4DRD3DRD2KMT2A
SCHEMBL13785133 0.80 OPRM1 (0.58) OPRM1DRD4DRD3DRD2KMT2A
SCHEMBL10263502 0.79 OPRM1 (0.53) OPRM1DRD4DRD3DRD2KMT2A
SCHEMBL13435360 0.78 KCNA3 (0.59) OPRM1KMT2ARAB9ANPSR1TET3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8039636-B2 Methods for making 4-tetrazolyl-4-phenylpiperidine compounds PURDUE PHARMA L.P. (US) 2011-10-18 US disclosed
US-8039636-B2 Methods for making 4-tetrazolyl-4-phenylpiperidine compounds PURDUE PHARMA L.P. (US) 2011-10-18 US disclosed
US-8039636-B2 Methods for making 4-tetrazolyl-4-phenylpiperidine compounds PURDUE PHARMA L.P. (US) 2011-10-18 US disclosed
US-7687518-B2 Therapeutic agents useful for treating pain PURDUE PHARMA L.P. (US) 2010-03-30 US disclosed
US-7687518-B2 Therapeutic agents useful for treating pain PURDUE PHARMA L.P. (US) 2010-03-30 US disclosed
US-20090240056-A1 METHODS FOR MAKING 4-TETRAZOLYL-4-PHENYLPIPERIDINE COMPOUNDS EURO-CELTIQUE S.A. (LU) 2009-09-24 US disclosed
US-20090240056-A1 METHODS FOR MAKING 4-TETRAZOLYL-4-PHENYLPIPERIDINE COMPOUNDS EURO-CELTIQUE S.A. (LU) 2009-09-24 US disclosed
US-20090240056-A1 METHODS FOR MAKING 4-TETRAZOLYL-4-PHENYLPIPERIDINE COMPOUNDS EURO-CELTIQUE S.A. (LU) 2009-09-24 US disclosed
US-7557219-B2 Methods for making 4-tetrazolyl-4-phenylpiperidine compounds PURDUE PHARMA L.P. (US) 2009-07-07 US disclosed
US-7557219-B2 Methods for making 4-tetrazolyl-4-phenylpiperidine compounds PURDUE PHARMA L.P. (US) 2009-07-07 US disclosed
US-7557219-B2 Methods for making 4-tetrazolyl-4-phenylpiperidine compounds PURDUE PHARMA L.P. (US) 2009-07-07 US disclosed
US-7202259-B2 Therapeutic agents useful for treating pain EURO-CELTIQUE S.A. (LU) 2007-04-10 US disclosed
US-7202259-B2 Therapeutic agents useful for treating pain EURO-CELTIQUE S.A. (LU) 2007-04-10 US disclosed
EP-1562932-B1 4-TETRAZOLYL-4-PHENYLPIPERIDINE DERIVATIVES FOR TREATING PAIN EURO CELTIQUE SA (LU) 2007-04-04 EP disclosed
US-20070072909-A1 deblocking, deprotecting; debenzylation; for preventing pain, diarrhea EURO-CELTIQUE S.A. 2007-03-29 US disclosed
US-20070072909-A1 deblocking, deprotecting; debenzylation; for preventing pain, diarrhea EURO-CELTIQUE S.A. 2007-03-29 US disclosed
US-20070072909-A1 deblocking, deprotecting; debenzylation; for preventing pain, diarrhea EURO-CELTIQUE S.A. 2007-03-29 US disclosed
EP-1709029-A2 METHODS FOR MAKING 4-TETRAZOLYL-4-PHENYLPIPERIDINE COMPOUNDS EURO-CELTIQUE S.A. (LU) 2006-10-11 EP disclosed
WO-2005075455-A2 METHODS FOR MAKING 4-TETRAZOLYL-4-PHENYLPIPERIDINE COMPOUNDS EURO-CELTIQUE S.A. (LU) 2005-08-18 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 (2 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-20070072909-A1 deblocking, deprotecting; debenzylation; for preventing pain, diarrhea OPRL1, DECR1, PKD1 OPRM1 250/4885DRD4 28/4885DRD3 7/4885
US-20090240056-A1 METHODS FOR MAKING 4-TETRAZOLYL-4-PHENYLPIPERIDINE COMPOUNDS NAT1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, AHR OPRM1 211/4885DRD4 43/4885DRD3 62/4885

“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.