SCHEMBL21028102

SCHEMBL21028102

CC(C)c1ccc(S(=O)(=O)NC2(C(N)=O)CC2)c2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.45
CCR8 P51685 5/20 0.38
FABP4 P15090 4/20 0.38
FABP5 Q01469 1/20 0.38
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
HSD11B1 P28845 5/20 0.36
ALDH1A1 P00352 2/20 0.34
CYP2D6 P10635 1/20 0.34
CXCR5 P32302 1/20 0.33
LMNA P02545 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
SCHEMBL16849173 0.89 CCR8 (0.39) BRD4CCR8FABP4FABP5CTSS
SCHEMBL16852627 0.83 BRD4 (0.47) BRD4CCR8FABP4CTSSCTSK
SCHEMBL21028150 0.81 BRD4 (0.51) BRD4CCR8FABP4CTSSCTSK
SCHEMBL18077846 0.81 BRD4 (0.45) BRD4CCR8FABP4CTSSCTSK
SCHEMBL15549189 0.81 FABP4 (0.47) BRD4FABP4FABP5CTSSCTSK
SCHEMBL16849852 0.80 PARG (0.45) CCR8FABP4FABP5ALDH1A1LMNA
SCHEMBL16849171 0.76 PARG (0.47) CCR8FABP4FABP5CTSSCTSK
SCHEMBL15549456 0.75 BRD4 (0.42) BRD4CTSSCTSKHSD11B1
SCHEMBL16849175 0.74 ALOX5AP (0.41) CCR8FABP4FABP5ALDH1A1LMNA
SCHEMBL16849106 0.72 ALDH1A1 (0.54) CCR8FABP4FABP5ALDH1A1LMNA

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 BRD4 982/4885CCR8 1015/4885FABP4 1424/4885

“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.