SCHEMBL21447324

SCHEMBL21447324

CN(C)C(CN)Cc1ccc(O)c(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OPRK1 P41145 4/20 0.51
▸ OPRM1 P35372 1/20 0.43
▸ OPRD1 P41143 1/20 0.43
▸ CA2 P00918 6/20 0.42
▸ ALOX15 P16050 5/20 0.42
▸ HSD17B10 Q99714 4/20 0.42
▸ ALOX12 P18054 3/20 0.42
▸ CYP3A4 P08684 3/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ RECQL P46063 3/20 0.42
▸ HIF1A Q16665 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ ESR1 P03372 2/20 0.42
▸ TP53 P04637 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ CYP1A2 P05177 2/20 0.42
▸ CYP2D6 P10635 2/20 0.42

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
SCHEMBL21447326 1.00 OPRK1 (0.51) OPRK1OPRM1OPRD1CA2ALOX15
SCHEMBL23357097 0.81 OPRK1 (0.43) OPRK1OPRD1ALOX15HSD17B10ALOX12
SCHEMBL23357095 0.81 OPRK1 (0.43) OPRK1OPRD1ALOX15HSD17B10ALOX12
SCHEMBL25152141 0.76 OPRD1 (0.58) OPRK1OPRM1OPRD1KDM4ERECQL
SCHEMBL20362245 0.76 OPRK1 (0.67) OPRK1OPRM1OPRD1ESR1SLC6A2
SCHEMBL18375280 0.76 OPRK1 (0.67) OPRK1OPRM1OPRD1ESR1SLC6A2
SCHEMBL14478214 0.75 PNMT (0.70) OPRK1CA2ALOX15HSD17B10ALOX12
SCHEMBL14944872 0.75 PNMT (0.70) OPRK1CA2ALOX15HSD17B10ALOX12
Hydrochloric Acid SCHEMBL23002160 0.75 OPRK1 (0.65) OPRK1OPRM1OPRD1ESR1SLC6A2
Hydrochloric Acid SCHEMBL20791713 0.75 OPRK1 (0.65) OPRK1OPRM1OPRD1ESR1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3774722-B1 OPIOID RECEPTOR MODULATORS AND PRODUCTS AND METHODS RELATED THERETO EPIODYNE INC (US) 2024-07-24 — — EP disclosed
US-20240092746-A1 OPIOID RECEPTOR MODULATORS EPIODYNE, INC. 2024-03-21 — — US disclosed
US-11634396-B2 Opioid receptor modulators EPIODYNE, INC. (US) 2023-04-25 — — US disclosed
US-11352316-B2 Opioid receptor modulators and products and methods related thereto EPIODYNE, INC. (US) 2022-06-07 — — US disclosed
US-20210163402-A1 OPIOID RECEPTOR MODULATORS AND PRODUCTS AND METHODS RELATED THERETO EPIODYNE, INC. 2021-06-03 — — US disclosed
CN-112867705-A Opioid receptor modulators and products and methods related thereto 埃皮欧黛公司 2021-05-28 — — CN disclosed
US-20210147343-A1 OPIOID RECEPTOR MODULATORS AND PRODUCTS AND METHODS RELATED THERETO EPIODYNE, INC. 2021-05-20 — — US disclosed
WO-2019195634-A1 OPIOID RECEPTOR MODULATORS AND PRODUCTS AND METHODS RELATED THERETO EPIODYNE, INC. (US) 2019-10-10 — — 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 (5 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-20240092746-A1 OPIOID RECEPTOR MODULATORS OPRM1, OPRK1, OPRL1 OPRK1 2/4885OPRM1 1/4885OPRD1 4/4885
US-11352316-B2 Opioid receptor modulators and products and methods related thereto OPRM1, OPRD1, OPRK1 OPRK1 3/4885OPRM1 1/4885OPRD1 2/4885
US-11634396-B2 Opioid receptor modulators OPRM1, OPRK1, OPRL1 OPRK1 2/4885OPRM1 1/4885OPRD1 4/4885
US-20210163402-A1 OPIOID RECEPTOR MODULATORS AND PRODUCTS AND METHODS RELATED THERETO OPRM1, OPRD1, OPRK1 OPRK1 3/4885OPRM1 1/4885OPRD1 2/4885
US-20210147343-A1 OPIOID RECEPTOR MODULATORS AND PRODUCTS AND METHODS RELATED THERETO OPRM1, OPRD1, OPRK1 OPRK1 3/4885OPRM1 1/4885OPRD1 2/4885

“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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