SCHEMBL15780657

SCHEMBL15780657

CC(C)CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(NC2CCN(C)CC2)nc1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RORC P51449 9/20 0.62
MCL1 Q07820 1/20 0.43
HTR2A P28223 2/20 0.41
HTR2C P28335 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
APOBEC3A P31941 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CCR6 P51684 3/20 0.38
RORA P35398 1/20 0.38
TDO2 P48775 1/20 0.38
CCNK O75909 1/20 0.38
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
CDK12 Q9NYV4 1/20 0.38

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
SCHEMBL15772372 0.91 RORC (0.75) RORCMCL1CCR6RORATDO2
SCHEMBL15772099 0.85 RORC (0.55) RORCMCL1ALDH1A1HTTL3MBTL1
SCHEMBL17276872 0.85 RORC (0.62) RORCMCL1RORATDO2
SCHEMBL17276727 0.79 RORC (0.59) RORCMCL1RORA
SCHEMBL28130169 0.77 RORC (0.48) RORCMCL1
SCHEMBL30778260 0.76 RORC (1.00) RORCHTR2ARORATDO2
SCHEMBL17276725 0.76 RORC (0.52) RORCMCL1KDM4EALDH1A1RORA
SCHEMBL15772696 0.75 RORC (0.58) RORCRORA
SCHEMBL15806720 0.75 RORC (0.45) RORCMCL1RORA
SCHEMBL15780656 0.74 ALDH1A1 (0.56) RORCMCL1ALDH1A1L3MBTL1

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-9382222-B2 Benzyl sulfonamide derivatives as RORc modulators GENENTECH, INC. (US) 2016-07-05 US disclosed
US-20140163024-A1 BENZYL SULFONAMIDE DERIVATIVES AS RORc MODULATORS GENENTECH, INC. (US) 2014-06-12 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-20140163024-A1 BENZYL SULFONAMIDE DERIVATIVES AS RORc MODULATORS RORC, RORA, RORB RORC 1/4885MCL1 1899/4885HTR2A 2574/4885

“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.