SCHEMBL1928616

SCHEMBL1928616

CN1C(=O)N(C2CCN(C3CCN(C(=O)OC(C)(C)C)CC3)CC2)[C@H]2CCCC[C@@H]21

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 6/20 0.45
OGFRL1 Q5TC84 3/20 0.45
OPRD1 P41143 2/20 0.45
OPRL1 P41146 3/20 0.44
EPHX1 P07099 1/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44
THRB P10828 1/20 0.44
HPGD P15428 1/20 0.43
OPRK1 P41145 2/20 0.41
HCAR1 Q9BXC0 1/20 0.39
GPR119 Q8TDV5 3/20 0.39
TP53 P04637 1/20 0.39
RECQL P46063 1/20 0.39
PTPN2 P17706 1/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 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
SCHEMBL1930034 0.95 EPHX1 (0.48) EPHX1KDM4EMAPTTHRBHPGD
SCHEMBL1929516 0.81 OPRM1 (0.45) OPRM1OGFRL1OPRD1EPHX1KDM4E
SCHEMBL1929893 0.80 OPRM1 (0.48) OPRM1OPRL1HPGD
SCHEMBL1929816 0.80 OPRM1 (0.62) OPRM1OGFRL1OPRD1OPRL1EPHX1
SCHEMBL1929054 0.80 OPRM1 (0.62) OPRM1OGFRL1OPRD1OPRL1EPHX1
SCHEMBL12532287 0.80 OPRM1 (0.62) OPRM1OGFRL1OPRD1OPRL1EPHX1
SCHEMBL1929561 0.80 OPRM1 (0.62) OPRM1OGFRL1OPRD1OPRL1EPHX1
SCHEMBL1928274 0.80 EPHX1 (0.45) EPHX1KDM4EMAPTTHRBHPGD
SCHEMBL13380553 0.80 OPRM1 (0.57) OPRM1OPRL1EPHX1KDM4EMAPT
SCHEMBL13380625 0.80 OPRM1 (0.57) OPRM1OPRL1EPHX1KDM4EMAPT

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
US-7956069-B2 Compounds ASTRAZENECA AB (SE) 2011-06-07 US disclosed
US-7956069-B2 Compounds ASTRAZENECA AB (SE) 2011-06-07 US disclosed
US-7956069-B2 Compounds ASTRAZENECA AB (SE) 2011-06-07 US disclosed
US-20070287695-A1 Novel Compounds ASTRAZENECA AB (SE) 2007-12-13 US disclosed
US-20070287695-A1 Novel Compounds ASTRAZENECA AB (SE) 2007-12-13 US disclosed
US-20070287695-A1 Novel Compounds ASTRAZENECA AB (SE) 2007-12-13 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-20070287695-A1 Novel Compounds OPRM1, OPRL1, OPRK1 OPRM1 1/4885OGFRL1 779/4885OPRD1 5/4885

“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.