SCHEMBL17710000

SCHEMBL17710000

CC(NS(=O)(=O)c1ccc(Br)c(C(F)(F)F)c1)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.41
MMP7 P09237 2/20 0.40
CCR2 P41597 3/20 0.39
PPARG P37231 1/20 0.38
NPSR1 Q6W5P4 2/20 0.38
MEP1B Q16820 1/20 0.38
EIF2AK3 Q9NZJ5 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
KIF11 P52732 1/20 0.37
HTT P42858 2/20 0.36
FFAR1 O14842 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
EPHX1 P07099 1/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
NR3C1 P04150 1/20 0.36

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
SCHEMBL17709999 1.00 RORC (0.41) RORCMMP7CCR2PPARGNPSR1
SCHEMBL16852788 0.84 RORC (0.41) RORCMMP7CCR2NPSR1CA1
SCHEMBL17721214 0.84 CCR2 (0.40) CCR2MEN1KMT2AL3MBTL1LMNA
SCHEMBL21028378 0.83 RORC (0.45) RORCMMP7CCR2NPSR1MEP1B
SCHEMBL17709815 0.83 ALDH1A1 (0.43) CCR2CA1CA2MEN1MAPT
SCHEMBL17709814 0.83 ALDH1A1 (0.43) CCR2CA1CA2MEN1MAPT
SCHEMBL21028141 0.82 RORC (0.42) RORCMMP7CCR2NPSR1MEP1B
SCHEMBL2371885 0.80 KIF11 (0.55) PPARGNPSR1MEP1BEIF2AK3CA1
SCHEMBL17709877 0.80 ALDH1A1 (0.43) RORCFFAR4MEN1MAPTKMT2A
SCHEMBL17709875 0.80 ALDH1A1 (0.43) RORCFFAR4MEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107108598-B Thiazoles as Ror gamma t modulators 詹森药业有限公司 2020-11-17 CN disclosed
EP-3212641-B1 THIAZOLES AS MODULATORS OF RORYT JANSSEN PHARMACEUTICA NV (BE) 2018-12-05 EP disclosed
US-10080744-B2 Thiazoles as modulators of RORγt JANSSEN PHARMACEUTICA NV (BE) 2018-09-25 US disclosed
US-20180064690-A1 THIAZOLES AS MODULATORS OF RORyt JANSSEN PHARMACEUTICA NV (BE) 2018-03-08 US disclosed
US-9861618-B2 Thiazoles as modulators of RORγt JANSSEN PHARMACEUTICA NV (BE) 2018-01-09 US disclosed
US-20160120850-A1 THIAZOLES AS MODULATORS OF RORyt JANSSEN PHARMACEUTICA NV (US) 2016-05-05 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 (3 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-20160120850-A1 THIAZOLES AS MODULATORS OF RORyt RORC, RORB, RORA RORC 1/4885MMP7 4097/4885CCR2 163/4885
US-10080744-B2 Thiazoles as modulators of RORγt RORB, RORA, RORC RORC 3/4885MMP7 4285/4885CCR2 167/4885
US-20180064690-A1 THIAZOLES AS MODULATORS OF RORyt RORC, RORB, RORA RORC 1/4885MMP7 3886/4885CCR2 154/4885

“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.