Batabulin

Batabulin

SCHEMBL6089508

COc1ccc(NS(=O)(=O)c2c(F)c(F)c(F)c(F)c2F)cc1F.[KH]

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.53
ALDH1A1 P00352 4/20 0.53
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
HTT P42858 3/20 0.53
THRB P10828 2/20 0.53
MAPT P10636 2/20 0.53
SMN1; SMN2 Q16637 5/20 0.50
PKM P14618 2/20 0.50
TSHR P16473 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
HPGD P15428 1/20 0.48
CA1 P00915 5/20 0.48
CA2 P00918 5/20 0.48
HTR6 P50406 1/20 0.47
CYP1A2 P05177 1/20 0.45
GLA P06280 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45

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
Batabulin SCHEMBL29373304 0.98 LMNA (0.54) LMNAALDH1A1MEN1KMT2AHTT
Batabulin SCHEMBL18845 0.98 LMNA (0.54) LMNAALDH1A1MEN1KMT2AHTT
Batabulin SCHEMBL6086887 0.97 LMNA (0.53) LMNAALDH1A1MEN1KMT2AHTT
SCHEMBL22909526 0.92 LMNA (0.51) LMNAALDH1A1MEN1KMT2AHTT
SCHEMBL29671221 0.92 LMNA (0.51) LMNAALDH1A1MEN1KMT2AHTT
SCHEMBL28762050 0.92 LMNA (0.51) LMNAALDH1A1MEN1KMT2AHTT
SCHEMBL31034621 0.91 CA1 (0.55) LMNAALDH1A1MEN1KMT2AHTT
Batabulin SCHEMBL7103854 0.91 LMNA (0.48) LMNAALDH1A1MEN1KMT2AHTT
SCHEMBL6673920 0.91 HTR6 (0.50) LMNAALDH1A1MEN1KMT2AHTT
SCHEMBL22909294 0.90 LMNA (0.50) LMNAALDH1A1MEN1KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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
EP-0896533-A4 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK INC (US) 1999-04-28 EP 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
EP-0896533-A2 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK, INC. (US) 1999-02-17 EP disclosed
WO-1997030677-A2 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK, INC. (US) 1997-08-28 WO 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 LMNA 4425/4885ALDH1A1 1192/4885MEN1 1013/4885
US-20020143036-A1 Pentafluorobenzenesulfonamides and analogs FFAR1, PCSK9, PFAS LMNA 2277/4885ALDH1A1 1403/4885MEN1 502/4885

“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.