SCHEMBL21028211

SCHEMBL21028211

CC(C)c1ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cc1OC(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RORC P51449 5/20 0.41
ALDH1A1 P00352 1/20 0.40
KCNK3 O14649 1/20 0.37
KCNK9 Q9NPC2 1/20 0.37
FFAR4 Q5NUL3 1/20 0.36
S100A9 P06702 1/20 0.35
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
ALOX15 P16050 1/20 0.34
MAPK1 P28482 1/20 0.34
CNR2 P34972 1/20 0.34
TNNI3K Q59H18 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
HRH4 Q9H3N8 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL21028122 0.89 RORC (0.41) RORCALDH1A1FFAR4S100A9KMT2A
SCHEMBL21028212 0.86 ALDH1A1 (0.39) RORCALDH1A1KMT2AMEN1ALOX15
SCHEMBL16852355 0.85 FFAR4 (0.42) RORCALDH1A1FFAR4S100A9KMT2A
SCHEMBL17709877 0.84 ALDH1A1 (0.43) RORCALDH1A1FFAR4S100A9KMT2A
SCHEMBL17709875 0.84 ALDH1A1 (0.43) RORCALDH1A1FFAR4S100A9KMT2A
SCHEMBL21026345 0.83 RORC (0.42) RORCALDH1A1FFAR4S100A9KMT2A
SCHEMBL21026346 0.83 PARG (0.46) ALDH1A1KCNK3KCNK9FFAR4KMT2A
SCHEMBL21028143 0.80 RORC (0.41) RORCALDH1A1NPSR1
SCHEMBL21028378 0.80 RORC (0.45) RORCNPSR1
SCHEMBL16849222 0.80 ALDH1A1 (0.43) RORCALDH1A1SMN1; SMN2NPSR1

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-10301272-B2 Carboxamide or sulfonamide substituted thiazoles and related derivatives as modulators for the orphan nuclear receptor ROR[γ] PHENEX PHARMACEUTICALS AG (DE) 2019-05-28 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-10301272-B2 Carboxamide or sulfonamide substituted thiazoles and related derivatives as modulators for the orphan nuclear receptor ROR[γ] RORA, RORB, RORC RORC 3/4885ALDH1A1 671/4885KCNK3 3348/4885

“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.