SCHEMBL16897451

SCHEMBL16897451

N#CC1(c2ccc(CBr)cc2)CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 5/20 0.39
OPRL1 P41146 2/20 0.38
IL4I1 Q96RQ9 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
SCHEMBL118612 0.88 OPRM1 (0.44) OPRM1OPRL1IL4I1
SCHEMBL6180992 0.83 ALDH1A1 (0.42) OPRM1OPRL1IL4I1
SCHEMBL3237390 0.81 OPRM1 (0.40) OPRM1
SCHEMBL3270477 0.77 OPRM1 (0.40) OPRM1
SCHEMBL625655 0.77 OPRM1 (0.40) OPRM1
SCHEMBL2131500 0.77 OPRM1 (0.58) OPRM1
SCHEMBL3903587 0.77 OPRM1 (0.40) OPRM1
SCHEMBL625403 0.77 OPRM1 (0.58) OPRM1OPRL1
SCHEMBL13594179 0.77 OPRM1 (0.60) OPRM1
SCHEMBL626037 0.77 OPRM1 (0.51) OPRM1OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3092239-B1 ARYL SULTAM DERIVATIVES AS RORC MODULATORS HOFFMANN LA ROCHE (CH) 2019-10-02 EP disclosed
EP-3092239-B1 ARYL SULTAM DERIVATIVES AS RORC MODULATORS HOFFMANN LA ROCHE (CH) 2019-10-02 EP disclosed
CN-105899507-B Aryl sultam derivative as RORc regulator 豪夫迈·罗氏有限公司 2019-06-07 CN disclosed
US-10131644-B2 Aryl sultam derivatives as RORc modulators GENENTECH, INC. (US) 2018-11-20 US disclosed
US-20170137393-A1 ARYL SULTAM DERIVATIVES AS RORc MODULATORS GENENTECH, INC. (US) 2017-05-18 US disclosed
US-20170137393-A1 ARYL SULTAM DERIVATIVES AS RORc MODULATORS GENENTECH, INC. (US) 2017-05-18 US disclosed
US-20170137393-A1 ARYL SULTAM DERIVATIVES AS RORc MODULATORS GENENTECH, INC. (US) 2017-05-18 US disclosed
EP-3092239-A1 ARYL SULTAM DERIVATIVES AS RORc MODULATORS F. Hoffmann-La Roche AG (CH) 2016-11-16 EP disclosed
CN-105899507-A Aryl sultam derivatives as rorc modulators 豪夫迈·罗氏有限公司 2016-08-24 CN disclosed
WO-2015104354-A1 ARYL SULTAM DERIVATIVES AS RORc MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2015-07-16 WO disclosed
WO-2015104354-A1 ARYL SULTAM DERIVATIVES AS RORc MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2015-07-16 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-10131644-B2 Aryl sultam derivatives as RORc modulators RORC, RORB, RORA OPRM1 56/4885OPRL1 521/4885IL4I1 994/4885
US-20170137393-A1 ARYL SULTAM DERIVATIVES AS RORc MODULATORS RORC, RORB, RORA OPRM1 56/4885OPRL1 521/4885IL4I1 994/4885

“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.