SCHEMBL3064465

SCHEMBL3064465

O=S(=O)(Nc1cnc2c(Cl)cccc2c1)c1cccnc1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC40A1 Q9NP59 8/20 0.58
GLO1 Q04760 1/20 0.55
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.47
KEAP1 Q14145 1/20 0.45
NFE2L2 Q16236 1/20 0.45
TSHR P16473 2/20 0.45
GAA P10253 1/20 0.44
ALPL P05186 1/20 0.44
ALOX12 P18054 1/20 0.44
ALDH1A1 P00352 1/20 0.43
BRD4 O60885 1/20 0.43
SNCA P37840 1/20 0.43

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
SCHEMBL3064501 0.87 SLC40A1 (0.54) SLC40A1GLO1KMT2AKEAP1ALPL
SCHEMBL3072255 0.86 SLC40A1 (0.59) SLC40A1GLO1KMT2AMEN1KEAP1
SCHEMBL3068083 0.85 SLC40A1 (0.58) SLC40A1GLO1KMT2AMEN1KEAP1
SCHEMBL3069811 0.85 SLC40A1 (0.64) SLC40A1GLO1KMT2AMEN1KEAP1
SCHEMBL3065919 0.83 MEN1 (0.53) SLC40A1KMT2AMEN1ALPLALOX12
SCHEMBL3072028 0.83 MEN1 (0.53) SLC40A1KMT2AMEN1GAAALPL
SCHEMBL3068831 0.82 SLC40A1 (0.55) SLC40A1GLO1KMT2AMEN1KEAP1
SCHEMBL3061517 0.82 KMT2A (0.59) SLC40A1GLO1KMT2AMEN1KEAP1
SCHEMBL3061297 0.81 RAB9A (0.50) SLC40A1KMT2ATSHRALPLALOX12
SCHEMBL3061548 0.80 GLO1 (0.56) SLC40A1GLO1ALPLALOX12BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7834049-B2 Sulfonamide compound for treating arteriosclerosis, psoriasis, colon cancer, retinal angiogenesis, diabetic retinopathy or inflammatory diseases EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-11-16 US disclosed
US-20100267754-A1 INTEGRIN EXPRESSION INHIBITOR WAKABAYASHI TOSHIAKI 2010-10-21 US disclosed
CN-100356979-C Integrin expression inhibitors EISAI CO LTD (JP) 2007-12-26 CN disclosed
EP-1243583-B1 HETEROCYCLIC COMPOUNDS HAVING SULFONAMIDE GROUPS EISAI CO LTD (JP) 2005-09-28 EP disclosed
US-20050176712-A1 Integrin expression inhibitor EISAI CO., LTD. 2005-08-11 US disclosed
US-6787534-B2 SUBSTITUTED QUINOLINE AND ISOQUINOLINE ANTIANGIOGENIC AGENTS; SULFONYLUREAS EISAI CO., LTD. (JP) 2004-09-07 US disclosed
US-20040018192-A1 Integrin expression inhibitors EISAI CO., LTD. (JP) 2004-01-29 US disclosed
US-20030144507-A1 Sulfonamide-containing heterocyclic compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2003-07-31 US disclosed
CN-1396833-A Integrin expression inhibitors EISAI CO LTD (JP) 2003-02-12 CN disclosed
EP-1243583-A1 HETEROCYCLIC COMPOUNDS HAVING SULFONAMIDE GROUPS Eisai Co., Ltd. (JP) 2002-09-25 EP 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 (4 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-20050176712-A1 Integrin expression inhibitor ITGB5, ITGB1, ITGB2 SLC40A1 3795/4885GLO1 4552/4885KMT2A 2009/4885
US-20100267754-A1 INTEGRIN EXPRESSION INHIBITOR ITGB5, ITGB1, ITGB2 SLC40A1 3795/4885GLO1 4552/4885KMT2A 2009/4885
US-20040018192-A1 Integrin expression inhibitors ITGB1, ITGB4, ITGB5 SLC40A1 3835/4885GLO1 4392/4885KMT2A 2523/4885
US-20030144507-A1 Sulfonamide-containing heterocyclic compounds SLC5A2, SLC5A1, CBR3 SLC40A1 2821/4885GLO1 652/4885KMT2A 1187/4885

“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.