SCHEMBL18156909

SCHEMBL18156909

CN(C)S(=O)(=O)c1cccc(CC(=O)Nc2ccc(C(C)(O)C(F)(F)F)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNJ6 P48051 3/20 0.53
KCNJ5 P48544 3/20 0.53
KCNJ3 P48549 3/20 0.53
LMNA P02545 3/20 0.53
ALDH1A1 P00352 5/20 0.48
MAPT P10636 3/20 0.48
RORC P51449 3/20 0.48
ABCC9 O60706 1/20 0.48
ABCC8 Q09428 1/20 0.48
KCNJ11 Q14654 1/20 0.48
KCNJ8 Q15842 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
NR1H3 Q13133 1/20 0.46
TRPV4 Q9HBA0 1/20 0.45
HSD11B1 P28845 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL18151624 0.91 RORC (0.60) KCNJ6KCNJ5KCNJ3LMNAALDH1A1
SCHEMBL18156906 0.87 ALDH1A1 (0.63) KCNJ6KCNJ5KCNJ3ALDH1A1MAPT
SCHEMBL18156912 0.86 RORC (0.49) LMNAALDH1A1MAPTRORCMEN1
SCHEMBL18156908 0.84 TSHR (0.53) LMNAALDH1A1MAPTRORCMEN1
SCHEMBL18156907 0.82 RORC (0.47) LMNAALDH1A1MAPTRORCMEN1
SCHEMBL18156927 0.81 PDK1 (0.48) LMNAALDH1A1MAPTRORCMEN1
SCHEMBL18156917 0.81 MAPT (0.47) LMNAALDH1A1MAPTRORCMEN1
SCHEMBL18151409 0.77 RORC (0.75) KCNJ6KCNJ5KCNJ3LMNAALDH1A1
SCHEMBL18156899 0.77 RORC (0.64) RORC
SCHEMBL18151833 0.77 RORC (0.61) MAPTRORCMEN1KMT2ANR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9738600-B2 ROR gamma (RORγ) modulators LEAD PHARMA CEL MODELS IP B.V. (NL) 2017-08-22 US disclosed
US-20160304448-A1 ROR GAMMA (RORy) MODULATORS LEAD PHARMA CEL MODELS IP B.V. (NL) 2016-10-20 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-20160304448-A1 ROR GAMMA (RORy) MODULATORS RORC, RORA, RORB KCNJ6 1622/4885KCNJ5 2309/4885KCNJ3 1406/4885

“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.