SCHEMBL21360769

SCHEMBL21360769

CC12CCCCCC(Cc3cc(C4CC4)c(O)cc31)C2N

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 6/20 0.66
▸ OPRD1 P41143 3/20 0.41
▸ OPRK1 P41145 3/20 0.41
▸ SIGMAR1 Q99720 4/20 0.32
▸ NUDT1 P36639 1/20 0.31
▸ BACE1 P56817 1/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ POLA1 P09884 2/20 0.31
▸ TMEM97 Q5BJF2 2/20 0.31
▸ KARS1 Q15046 1/20 0.31
▸ MRGPRX2 Q96LB1 2/20 0.30

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
SCHEMBL21360719 0.89 OPRM1 (0.74) OPRM1OPRD1OPRK1SIGMAR1POLA1
SCHEMBL21360674 0.85 OPRM1 (0.69) OPRM1OPRD1OPRK1SIGMAR1POLA1
SCHEMBL22477177 0.84 OPRM1 (0.67) OPRM1OPRD1OPRK1SIGMAR1POLA1
SCHEMBL21360675 0.84 OPRM1 (0.67) OPRM1OPRD1OPRK1SIGMAR1POLA1
SCHEMBL21360672 0.84 OPRM1 (0.67) OPRM1OPRD1OPRK1SIGMAR1POLA1
SCHEMBL21360785 0.83 OPRM1 (0.63) OPRM1OPRD1OPRK1POLA1KARS1
SCHEMBL21360822 0.83 OPRM1 (0.63) OPRM1OPRD1OPRK1POLA1KARS1
SCHEMBL21360690 0.82 OPRM1 (0.65) OPRM1OPRD1OPRK1HSP90AA1KARS1
SCHEMBL21360678 0.82 OPRM1 (0.65) OPRM1OPRD1OPRK1HSP90AA1KARS1
Dezocine SCHEMBL21081189 0.80 OPRM1 (1.00) OPRM1OPRD1OPRK1SIGMAR1MRGPRX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3401306-B1 DEZOCINE ANALOGUE SHANDONG DANHONG PHARMACEUTICAL CO LTD (CN) 2020-09-30 — — EP disclosed
US-10414718-B2 Dezocine analogue SHANDONG DANHONG PHARMACEUTICAL CO., LTD. (CN) 2019-09-17 — — 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-10414718-B2 Dezocine analogue DDO, DDC, DAO OPRM1 9/4885OPRD1 359/4885OPRK1 93/4885

“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.

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