SCHEMBL26426366

SCHEMBL26426366

CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)C2(CCCC2=O)C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 1/20 0.44
OPRK1 P41145 1/20 0.44
ACHE P22303 1/20 0.41
USP30 Q70CQ3 1/20 0.41
GPR119 Q8TDV5 2/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
CYP11B2 P19099 1/20 0.40
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
STS P08842 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP2D6 P10635 1/20 0.39
RORC P51449 1/20 0.39
SCD5 Q86SK9 1/20 0.39
TACR1 P25103 1/20 0.38
DTYMK P23919 1/20 0.38
CKS1B P61024 1/20 0.38
SKP1 P63208 1/20 0.38

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
SCHEMBL19839907 0.82 OPRD1 (0.46) OPRD1OPRK1ACHEUSP30GPR119
SCHEMBL1049597 0.81 OPRD1 (0.49) OPRD1OPRK1ACHEUSP30GPR119
SCHEMBL19124768 0.78 OPRD1 (0.46) OPRD1OPRK1ACHEUSP30GPR119
SCHEMBL17467896 0.77 OPRD1 (0.45) OPRD1OPRK1ACHEUSP30GPR119
SCHEMBL322502 0.77 OPRD1 (0.48) OPRD1OPRK1USP30GPR119HDAC1
SCHEMBL323450 0.77 OPRD1 (0.54) OPRD1OPRK1ACHEGPR119HDAC1
SCHEMBL20722852 0.76 OPRD1 (0.45) OPRD1OPRK1ACHEUSP30GPR119
SCHEMBL1555874 0.76 OPRD1 (0.49) OPRD1OPRK1USP30HDAC1HDAC8
SCHEMBL14902797 0.75 EPHX2 (0.55) OPRD1OPRK1ACHEUSP30GPR119
SCHEMBL21731415 0.75 OPRD1 (0.44) OPRD1OPRK1ACHEGPR119HDAC1

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-20230131402-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF APTINYX INC (US) 2023-04-27 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-20230131402-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A OPRD1 38/4885OPRK1 30/4885ACHE 474/4885

“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.