SCHEMBL6982155

SCHEMBL6982155

CC1(c2cccc(NS(C)(=O)=O)c2)C2C(=O)N(Cc3ccccc3)C(=O)C21

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 6/20 0.57
SIGMAR1 Q99720 1/20 0.45
NR3C1 P04150 3/20 0.44
KCNH2 Q12809 2/20 0.41
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
DRD3 P35462 1/20 0.40
KEAP1 Q14145 1/20 0.40
OPRD1 P41143 2/20 0.40
OPRK1 P41145 2/20 0.40
ACHE P22303 1/20 0.39

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
SCHEMBL4697742 0.87 OPRM1 (0.55) OPRM1SIGMAR1NR3C1KCNH2DRD2
SCHEMBL5755550 0.80 OPRM1 (0.78) OPRM1SIGMAR1NR3C1KCNH2OPRD1
SCHEMBL6984869 0.78 ELANE (0.44) OPRM1OPRK1ACHE
SCHEMBL6986198 0.75 TDP1 (0.54) SIGMAR1ACHE
SCHEMBL5756455 0.74 OPRM1 (0.88) OPRM1NR3C1KCNH2DRD2DRD3
SCHEMBL6654316 0.73 OPRM1 (0.63) OPRM1SIGMAR1OPRD1OPRK1
SCHEMBL6654313 0.73 OPRM1 (0.63) OPRM1SIGMAR1OPRD1OPRK1
SCHEMBL5756815 0.73 OPRM1 (0.66) OPRM1SIGMAR1NR3C1KCNH2DRD2
SCHEMBL5753484 0.73 OPRM1 (1.00) OPRM1NR3C1KCNH2OPRD1OPRK1
SCHEMBL5754539 0.72 OPRM1 (0.94) OPRM1NR3C1KCNH2OPRD1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030207876-A1 3-Azabicyclo[3.1.0]hexane derivatives useful in therapy PFIZER, INC. 2003-11-06 US disclosed
EP-1292574-A1 3-AZABICYCLO[3.1.0]HEXANE DERIVATIVES HAVING OPIOID RECEPTOR AFFINITY PFIZER INC. (US) 2003-03-19 EP disclosed
US-20020025948-A1 3-azabicyclo[3.1.0]hexane derivatives useful in therapy PFIZER INC. 2002-02-28 US disclosed
WO-2001098267-A1 3-AZABICYCLO (3.1.0) HEXANE DERIVATIVES HAVING OPIOID RECEPTOR AFFINITY PFIZER LIMITED (GB) 2001-12-27 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 (2 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-20030207876-A1 3-Azabicyclo[3.1.0]hexane derivatives useful in therapy OPRD1, OPRK1, OPRM1 OPRM1 3/4885SIGMAR1 20/4885NR3C1 123/4885
US-20020025948-A1 3-azabicyclo[3.1.0]hexane derivatives useful in therapy OPRD1, OPRK1, OPRM1 OPRM1 3/4885SIGMAR1 20/4885NR3C1 123/4885

“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.