SCHEMBL3215709

SCHEMBL3215709

C[C@@H]1CCCN1S(=O)(=O)c1ccccc1-c1ccc(C=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 10/20 0.48
OPRM1 P35372 9/20 0.48
ALOX15 P16050 1/20 0.45
ALOX5AP P20292 4/20 0.41
FEN1 P39748 3/20 0.41
ACHE P22303 1/20 0.41
PSEN1 P49768 1/20 0.40
PSEN2 P49810 1/20 0.40
APH1B Q8WW43 1/20 0.40
NCSTN Q92542 1/20 0.40
APH1A Q96BI3 1/20 0.40
PSENEN Q9NZ42 1/20 0.40
KCNH2 Q12809 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL3215721 1.00 OPRK1 (0.48) OPRK1OPRM1ALOX15ALOX5APFEN1
SCHEMBL3224264 0.82 OPRK1 (0.66) OPRK1OPRM1ALOX5APFEN1KCNH2
SCHEMBL3224254 0.82 OPRK1 (0.66) OPRK1OPRM1ALOX5APFEN1KCNH2
SCHEMBL28969716 0.82 ALOX15 (0.54) OPRK1OPRM1ALOX15PSEN1PSEN2
SCHEMBL3219561 0.80 OPRM1 (0.64) OPRK1OPRM1ALOX5APFEN1KCNH2
SCHEMBL25171307 0.79 PSEN1 (0.62) ACHEPSEN1PSEN2APH1BNCSTN
SCHEMBL29010641 0.79 OPRK1 (0.49) OPRK1OPRM1ALOX15ALOX5APFEN1
SCHEMBL3213443 0.78 OPRK1 (0.77) OPRK1OPRM1KCNH2
SCHEMBL3219508 0.78 OPRK1 (0.77) OPRK1OPRM1KCNH2
SCHEMBL3219520 0.78 OPRK1 (0.77) OPRK1OPRM1KCNH2

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-20100035873-A1 Diaryl Compounds and Uses Thereof PFIZER INC 2010-02-11 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-20100035873-A1 Diaryl Compounds and Uses Thereof OPRK1, OPRD1, OPRL1 OPRK1 1/4885OPRM1 4/4885ALOX15 2226/4885

“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.