SCHEMBL18878761

SCHEMBL18878761

CN1CC[C@@]23CC(=O)CC[C@@H]2[C@@H]1Cc1ccc(OCc2ccccc2)c(OS(=O)(=O)C(F)(F)F)c13

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.53
OPRM1 P35372 7/20 0.47
OPRD1 P41143 5/20 0.47
OPRK1 P41145 3/20 0.47
GRIN2D O15399 2/20 0.46
GRIN3B O60391 2/20 0.46
GRIN1 Q05586 2/20 0.46
GRIN2A Q12879 2/20 0.46
GRIN2B Q13224 2/20 0.46
GRIN2C Q14957 2/20 0.46
GRIN3A Q8TCU5 2/20 0.46
LMNA P02545 1/20 0.39
PDE4D Q08499 1/20 0.39
MRGPRX2 Q96LB1 1/20 0.39
SIGMAR1 Q99720 1/20 0.38
TMEM97 Q5BJF2 1/20 0.36

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
SCHEMBL16444882 1.00 GAA (0.53) GAAOPRM1OPRD1OPRK1GRIN2D
SCHEMBL16454918 0.88 GAA (0.54) GAAOPRM1OPRD1OPRK1GRIN2D
SCHEMBL16445412 0.88 GAA (0.67) GAAOPRM1OPRD1OPRK1LMNA
SCHEMBL20820915 0.85 GAA (0.37) GAAOPRM1OPRD1OPRK1GRIN2D
SCHEMBL16451334 0.84 GAA (0.56) GAAOPRM1OPRD1OPRK1GRIN2D
SCHEMBL16451316 0.84 GAA (0.56) GAAOPRM1OPRD1OPRK1GRIN2D
SCHEMBL21600566 0.83 GAA (0.73) GAAOPRM1OPRD1OPRK1GRIN2D
SCHEMBL22865971 0.83 GAA (0.73) GAAOPRM1OPRD1OPRK1GRIN2D
SCHEMBL21600228 0.83 GAA (0.73) GAAOPRM1OPRD1OPRK1GRIN2D
SCHEMBL16445988 0.83 GAA (0.73) GAAOPRM1OPRD1OPRK1GRIN2D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230158017-A1 METHODS FOR TREATING DEPRESSIVE SYMPTOMS JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2023-05-25 US disclosed
US-11534436-B2 Methods for treating depressive symptoms ALKERMES PHARMA IRELAND LIMITED (IE) 2022-12-27 US disclosed
US-20210000818-A1 METHODS FOR TREATING DEPRESSIVE SYMPTOMS JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2021-01-07 US disclosed
US-10736890-B2 Methods for treating depressive symptoms ALKERMES PHARMA IRELAND LIMITED (IE) 2020-08-11 US disclosed
US-20190167666-A1 METHODS FOR TREATING DEPRESSIVE SYMPTOMS ALKERMES PHARMA IRELAND LIMITED (IE) 2019-06-06 US disclosed
US-10287250-B2 Morphan and morphinan analogues, and methods of use ALKERMES PHARMA IRELAND LIMITED (IE) 2019-05-14 US disclosed
US-20180016237-A1 Morphan And Morphinan Analogues, And Methods Of Use JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2018-01-18 US disclosed
US-9682936-B2 Morphan and morphinan analogues, and methods of use ALKERMES PHARMA IRELAND LIMITED (IE) 2017-06-20 US disclosed
US-9656961-B2 Methods for treating depressive symptoms ALKERMES PHARMA IRELAND LIMITED (IE) 2017-05-23 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 (7 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-20190167666-A1 METHODS FOR TREATING DEPRESSIVE SYMPTOMS OPRM1, OPRL1, OPRK1 GAA 1347/4885OPRM1 1/4885OPRD1 4/4885
US-20210000818-A1 METHODS FOR TREATING DEPRESSIVE SYMPTOMS OPRM1, OPRL1, OPRK1 GAA 1347/4885OPRM1 1/4885OPRD1 4/4885
US-10287250-B2 Morphan and morphinan analogues, and methods of use MTPN, UTRN, FSCN1 GAA 374/4885OPRM1 159/4885OPRD1 642/4885
US-20180016237-A1 Morphan And Morphinan Analogues, And Methods Of Use MTPN, UTRN, FSCN1 GAA 398/4885OPRM1 159/4885OPRD1 666/4885
US-20230158017-A1 METHODS FOR TREATING DEPRESSIVE SYMPTOMS OPRM1, OPRL1, OPRK1 GAA 1347/4885OPRM1 1/4885OPRD1 4/4885
US-11534436-B2 Methods for treating depressive symptoms OPRM1, OPRL1, OPRK1 GAA 1347/4885OPRM1 1/4885OPRD1 4/4885
US-10736890-B2 Methods for treating depressive symptoms OPRM1, OPRL1, OPRK1 GAA 1347/4885OPRM1 1/4885OPRD1 4/4885

“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.