SCHEMBL5095284

SCHEMBL5095284

COC(=O)CN1CN(c2ccccc2)C2(CCN([C@H]3CC[C@H](C(C)C)CC3)CC2)C1=O

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 12/20 0.72
OPRM1 P35372 8/20 0.60
OPRK1 P41145 6/20 0.60
MEN1 O00255 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C9 P11712 1/20 0.56
KMT2A Q03164 1/20 0.56
BDKRB2 P30411 1/20 0.52
OPRD1 P41143 5/20 0.51
NPC1L1 Q9UHC9 3/20 0.51
ENPP2 Q13822 1/20 0.48
DDR1 Q08345 1/20 0.48

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
SCHEMBL5095281 1.00 OPRL1 (0.72) OPRL1OPRM1OPRK1MEN1CYP3A4
SCHEMBL15794592 0.90 OPRL1 (0.68) OPRL1OPRM1OPRK1BDKRB2OPRD1
SCHEMBL15794593 0.90 OPRL1 (0.68) OPRL1OPRM1OPRK1BDKRB2OPRD1
SCHEMBL15807238 0.90 OPRL1 (0.68) OPRL1OPRM1OPRK1BDKRB2OPRD1
SCHEMBL7709408 0.89 OPRL1 (0.61) OPRL1OPRM1OPRK1MEN1CYP3A4
Hydrochloric Acid SCHEMBL7706313 0.88 OPRL1 (0.60) OPRL1OPRM1OPRK1MEN1CYP3A4
SCHEMBL5095033 0.84 OPRL1 (1.00) OPRL1OPRM1OPRK1OPRD1
SCHEMBL5095036 0.84 OPRL1 (1.00) OPRL1OPRM1OPRK1OPRD1
SCHEMBL5094949 0.82 OPRL1 (0.75) OPRL1OPRM1OPRK1OPRD1
SCHEMBL5094953 0.82 OPRL1 (0.75) OPRL1OPRM1OPRK1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080287478-A1 Nociceptin Analogues and Uses Thereof ZEALAND PHARMA A/S (DK) 2008-11-20 US disclosed
EP-1628978-A2 TRIAZA-SPIRO COMPOUNDS AS NOCICEPTIN ANALOGUES AND USES THEREOF Zealand Pharma A/S (DK) 2006-03-01 EP disclosed
WO-2004104004-A2 TRIAZA-SPIRO COMPOUNDS AS NOCICEPTIN ANALOGUES AND USES THEREOF ZEALAND PHARMA A/S (DK) 2004-12-02 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-20080287478-A1 Nociceptin Analogues and Uses Thereof OPRL1, NPSR1, OPRK1 OPRL1 1/4885OPRM1 14/4885OPRK1 3/4885

“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.