SCHEMBL6086477

SCHEMBL6086477

CCN(c1ccc(N(C)C)cc1)S(=O)(=O)c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.47
TSHR P16473 3/20 0.46
MAPK1 P28482 2/20 0.46
HSD17B10 Q99714 2/20 0.46
KMT2A Q03164 1/20 0.46
ESR1 P03372 3/20 0.46
NR1I2 O75469 2/20 0.40
RORC P51449 2/20 0.40
RORA P35398 1/20 0.40
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
RORB Q92753 1/20 0.40
NR1H4 Q96RI1 1/20 0.40
HSD11B1 P28845 1/20 0.39
LMNA P02545 1/20 0.39
ALDH1A1 P00352 3/20 0.37
HDAC8 Q9BY41 2/20 0.37
HDAC3 O15379 1/20 0.37
HDAC11 Q96DB2 1/20 0.37
ALOX15 P16050 1/20 0.37

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
SCHEMBL8107081 0.85 MAPK1 (0.64) TSHRMAPK1HSD17B10KMT2AESR1
SCHEMBL6086563 0.79 HDAC6 (0.48) HDAC6TSHRHSD17B10KMT2AALDH1A1
SCHEMBL7541154 0.72 ALDH1A1 (0.56) HDAC6TSHRMAPK1HSD17B10KMT2A
SCHEMBL7538012 0.71 HDAC6 (0.48) HDAC6TSHRMAPK1HSD17B10ALDH1A1
SCHEMBL18531401 0.70 HDAC6 (0.44) HDAC6TSHRMAPK1HSD17B10KMT2A
SCHEMBL6086664 0.68 CA1 (0.58) HDAC6MAPK1LMNAALDH1A1
Hydrochloric Acid SCHEMBL6088955 0.67 CA1 (0.57) HDAC6MAPK1LMNAALDH1A1
SCHEMBL6087539 0.66 RAB9A (0.45) TSHRESR1LMNAALDH1A1ALOX15
SCHEMBL8629125 0.66 HDAC6 (0.40) HDAC6TSHRMAPK1HSD17B10KMT2A
SCHEMBL22909271 0.65 CA1 (0.43) HDAC6LMNAALDH1A1HDAC8HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7138418-B2 For therapy of atherosclerosis and hypercholesterolemia; 5-Pentafluorophenylsulfonamidoindazole for example; increasing LDL receptor gene expression in a cell AMGEN, INC. (US) 2006-11-21 US disclosed
US-6962929-B2 Pentafluorobenzenesulfonamides and analogs TULARIK INC. (US) 2005-11-08 US disclosed
EP-0939627-B1 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK INC (US) 2003-09-10 EP disclosed
EP-0896533-B1 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK INC (US) 2003-09-10 EP disclosed
US-20030162817-A1 Pentafluorobenzenesulfonamides and analogs TULARIK INC. 2003-08-28 US disclosed
EP-1334719-A2 Pentafluorobenzenesulfonamides and analogs TULARIK, INC. (US) 2003-08-13 EP disclosed
US-6482860-B1 such as batabulin (2-Fluoro-1-methoxy-4-pentafluorophenylsulfonamidobenzene), use as antiproliferative agents to treat cancer TULARIK INC. 2002-11-19 US disclosed
US-20020143036-A1 Pentafluorobenzenesulfonamides and analogs TULARIK INC. 2002-10-03 US disclosed
US-6316484-B1 FOR THERAPY OR PROPHYLAXIS OF ATHEROSCLEROSIS AND HYPERCHOLESTEROLEMIA TULARIK INC. 2001-11-13 US disclosed
US-6121304-A SUCH AS 1-(PENTAFLUOROPHENYLSULFONYL)INDOLE; USEFUL IN TREATING ATHEROSCLEROSIS AND HYPERCHOLESTEROLERNIA TULARIK INC (US) 2000-09-19 US disclosed
US-5880151-A TREATING OR PREVENTING DISEASE CHARACTERIZED BY HIGH LEVELS OF LOW DENSITY LIPOPROTEIN PARTICLES OR CHOLESTEROL IN BLOOD TULARIK INC. (US) 1999-03-09 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 (2 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-20030162817-A1 Pentafluorobenzenesulfonamides and analogs FGFR1, FPR1, FGF1 HDAC6 1077/4885TSHR 1857/4885MAPK1 163/4885
US-20020143036-A1 Pentafluorobenzenesulfonamides and analogs FFAR1, PCSK9, PFAS HDAC6 1204/4885TSHR 1540/4885MAPK1 237/4885

“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.