SCHEMBL16640882

SCHEMBL16640882

COc1nc2ccc(-c3cnc(C)n3C)cc2c(C#N)c1Cc1cccc(C(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RORC P51449 19/20 0.56
KDM4E B2RXH2 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
SCHEMBL16640823 0.91 RORC (0.66) RORC
SCHEMBL16633200 0.85 RORC (0.76) RORC
SCHEMBL16640883 0.85 RORC (0.49) RORC
SCHEMBL16639557 0.82 RORC (0.72) RORC
SCHEMBL16639454 0.80 RORC (0.71) RORC
SCHEMBL16640866 0.78 RORC (0.51) RORC
SCHEMBL16640839 0.78 RORC (0.73) RORC
SCHEMBL16633003 0.76 RORC (0.88) RORC
SCHEMBL16640797 0.73 RORC (0.55) RORC
SCHEMBL16632873 0.73 RORC (0.85) RORC

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-20150105366-A1 METHYLENE LINKED QUINOLINYL MODULATORS OF RORyt JANSSEN PHARMACEUTICA NV (BE) 2015-04-16 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-20150105366-A1 METHYLENE LINKED QUINOLINYL MODULATORS OF RORyt RORC, RORA, RORB RORC 1/4885KDM4E 1105/4885

“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.