SCHEMBL21360672

SCHEMBL21360672

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

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 7/20 0.67
▸ OPRK1 P41145 4/20 0.42
▸ OPRD1 P41143 2/20 0.42
▸ CYP19A1 P11511 1/20 0.32
▸ DRD5 P21918 1/20 0.32
▸ POLA1 P09884 6/20 0.31
▸ KARS1 Q15046 1/20 0.31
▸ SIGMAR1 Q99720 1/20 0.31
▸ HSD11B1 P28845 1/20 0.31

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 0.90 OPRM1 (0.74) OPRM1OPRK1OPRD1POLA1KARS1
SCHEMBL21360674 0.86 OPRM1 (0.69) OPRM1OPRK1OPRD1CYP19A1POLA1
SCHEMBL21360675 0.85 OPRM1 (0.67) OPRM1OPRK1OPRD1CYP19A1POLA1
SCHEMBL22477177 0.85 OPRM1 (0.67) OPRM1OPRK1OPRD1CYP19A1POLA1
SCHEMBL21360769 0.84 OPRM1 (0.66) OPRM1OPRK1OPRD1POLA1KARS1
SCHEMBL21360722 0.83 OPRM1 (0.58) OPRM1OPRK1OPRD1DRD5POLA1
SCHEMBL21360690 0.83 OPRM1 (0.65) OPRM1OPRK1OPRD1CYP19A1KARS1
SCHEMBL21360678 0.83 OPRM1 (0.65) OPRM1OPRK1OPRD1CYP19A1KARS1
SCHEMBL21360822 0.82 OPRM1 (0.63) OPRM1OPRK1OPRD1POLA1KARS1
SCHEMBL11703178 0.81 OPRM1 (0.72) OPRM1OPRK1OPRD1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 9/4885OPRK1 93/4885OPRD1 359/4885

“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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