SCHEMBL20714580

SCHEMBL20714580

O=C(Cc1ncc(S(=O)(=O)CC2CC2)cn1)Nc1ccc(C(O)(F)C(F)(F)F)cc1

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RORC P51449 20/20 0.46
KCNH2 Q12809 4/20 0.45
CYP2D6 P10635 3/20 0.43

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
SCHEMBL18281158 0.93 RORC (0.55) RORCKCNH2CYP2D6
SCHEMBL18275198 0.81 RORC (0.56) RORCKCNH2CYP2D6
SCHEMBL16799959 0.78 RORC (0.76) RORCKCNH2CYP2D6
SCHEMBL20239345 0.77 RORC (0.59) RORC
SCHEMBL20239353 0.77 RORC (0.59) RORC
SCHEMBL20239346 0.77 RORC (0.59) RORC
SCHEMBL18281161 0.76 RORC (0.58) RORCKCNH2CYP2D6
SCHEMBL18275208 0.76 RORC (0.60) RORCKCNH2CYP2D6
SCHEMBL20180720 0.76 RORC (0.48) RORCKCNH2CYP2D6
SCHEMBL16799539 0.76 RORC (0.63) 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-20190040012-A1 ROR GAMMA (RORY) MODULATORS LEAD PHARMA HOLDING B.V. (NL) 2019-02-07 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-20190040012-A1 ROR GAMMA (RORY) MODULATORS RORC, RORA, RORB RORC 1/4885KCNH2 2115/4885CYP2D6 580/4885

“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.