SCHEMBL23065403

SCHEMBL23065403

CCOC(=O)C1(C(=O)OCC)CC=C(C)CC1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 9/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
OPRD1 P41143 3/20 0.37
OPRK1 P41145 3/20 0.37
SLC22A1 O15245 1/20 0.37
SLC6A4 P31645 1/20 0.37
ADRA1A P35348 1/20 0.37
KCNH2 Q12809 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
POLB P06746 1/20 0.36
ATM Q13315 1/20 0.34

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
SCHEMBL10938727 0.90 SMN1; SMN2 (0.39) OPRM1SMN1; SMN2OPRD1OPRK1SLC22A1
SCHEMBL10941629 0.85 OPRM1 (0.37) OPRM1SMN1; SMN2OPRD1OPRK1SLC22A1
SCHEMBL15129681 0.82 NPSR1 (0.32) SMN1; SMN2MEN1KMT2A
SCHEMBL610749 0.82 POLB (0.38) OPRM1SMN1; SMN2OPRD1OPRK1SLC22A1
SCHEMBL19338176 0.82 OPRM1 (0.35) OPRM1SMN1; SMN2OPRD1OPRK1SLC22A1
SCHEMBL16841462 0.81 PRMT1 (0.41) OPRM1SMN1; SMN2OPRD1OPRK1SLC22A1
SCHEMBL4740320 0.78 POLB (0.35) OPRM1SMN1; SMN2OPRD1OPRK1SLC22A1
SCHEMBL15348156 0.76 MEN1 (0.47) OPRM1SMN1; SMN2OPRK1MEN1KMT2A
SCHEMBL9634363 0.76
SCHEMBL15166801 0.75 P2RX7 (0.41) OPRM1SMN1; SMN2OPRD1OPRK1SLC22A1

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
US-20230039502-A1 COMPOUNDS FOR SELECTIVE BINDING TO ESTROGEN RECEPTORS ALPHA/BETA RELATIVE TO GPER/GPR30 AND METHODS OF TREATING DISEASE STATES AND CONDITIONS MEDIATED THROUGH THESE RECEPTORS UNM RAINFOREST INNOVATIONS 2023-02-09 US disclosed
WO-2021041107-A1 COMPOUNDS FOR SELECTIVE BINDING TO ESTROGEN RECEPTORS ALPHA/BETA RELATIVE TO GPER/GPR30 UNM RAINFOREST INNOVATIONS (US) 2021-03-04 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 (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-20230039502-A1 COMPOUNDS FOR SELECTIVE BINDING TO ESTROGEN RECEPTORS ALPHA/BETA RELATIVE TO GPER/GPR30 AND METHODS OF TREATING DISEASE STATES AND CONDITIONS MEDIATED THROUGH THESE RECEPTORS GPER1, GPR35, GPR34 OPRM1 99/4885SMN1; SMN2 1600/4885OPRD1 100/4885

“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.