SCHEMBL4518697

SCHEMBL4518697

CCN(CC)C(=N)c1ccc2c(c1)Oc1ccccc1C2C1CC2CCC(C1)N2Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.41
OPRM1 P35372 7/20 0.38
OPRD1 P41143 4/20 0.38
OPRK1 P41145 9/20 0.38
KCNH2 Q12809 8/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CHRNB2 P17787 1/20 0.35
CHRNA7 P36544 1/20 0.35
CHRNA4 P43681 1/20 0.35

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
SCHEMBL4507420 0.91 OPRM1 (0.44) OPRM1OPRD1
SCHEMBL4516991 0.90
SCHEMBL4518648 0.90 OPRD1 (0.47) USP2OPRM1OPRD1OPRK1KCNH2
SCHEMBL4516858 0.88 OPRM1 (0.40) USP2OPRM1OPRD1OPRK1KCNH2
SCHEMBL4505597 0.87 OPRM1 (0.40) USP2OPRM1OPRD1OPRK1KCNH2
SCHEMBL4508136 0.81 OPRM1 (0.54) OPRM1OPRD1
SCHEMBL5197378 0.81 OPRM1 (0.42) OPRM1OPRD1OPRK1
SCHEMBL4511678 0.81 MEN1 (0.40) USP2OPRM1OPRD1KCNH2MEN1
SCHEMBL4513186 0.80 MEN1 (0.38) USP2OPRM1OPRD1MEN1KMT2A
SCHEMBL5097094 0.80 OPRM1 (0.44) OPRM1OPRD1OPRK1KCNH2CHRNA4

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-7589104-B2 Tricyclic-bridged piperidinyline derivatives as §-opioid modulators JANSSEN PHARMACEUTICA NV (BE) 2009-09-15 US claimed
US-20060135524-A1 Tricyclic delta-opioid modulators JANSSEN PHARMACEUTICA N.V. (BE) 2006-06-22 US claimed
US-7589104-B2 Tricyclic-bridged piperidinyline derivatives as §-opioid modulators JANSSEN PHARMACEUTICA NV (BE) 2009-09-15 US disclosed
US-7589104-B2 Tricyclic-bridged piperidinyline derivatives as §-opioid modulators JANSSEN PHARMACEUTICA NV (BE) 2009-09-15 US disclosed
US-7589104-B2 Tricyclic-bridged piperidinyline derivatives as §-opioid modulators JANSSEN PHARMACEUTICA NV (BE) 2009-09-15 US disclosed
US-20060135524-A1 Tricyclic delta-opioid modulators JANSSEN PHARMACEUTICA N.V. (BE) 2006-06-22 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-20060135524-A1 Tricyclic delta-opioid modulators OPRD1, OPRK1, OPRL1 USP2 3363/4885OPRM1 4/4885OPRD1 1/4885

“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.