SCHEMBL3070535

SCHEMBL3070535

O=S(=O)(Nc1cnc2c(Br)cccc2c1)c1ccc(Cl)nc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
GAA P10253 2/20 0.47
ALPL P05186 4/20 0.45
KDM4E B2RXH2 2/20 0.45
CCR2 P41597 1/20 0.44
LMNA P02545 3/20 0.42
HTT P42858 3/20 0.42
MAPK1 P28482 1/20 0.42
ALOX12 P18054 1/20 0.41
PKM P14618 1/20 0.41
KMT2A Q03164 5/20 0.41
RAB9A P51151 1/20 0.41
MEN1 O00255 4/20 0.41
MAPT P10636 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL3064412 0.85 PIK3CG (0.46) ALDH1A1ALPLKDM4ELMNAHTT
SCHEMBL3070341 0.84 GLO1 (0.52) ALDH1A1GAAALPLKDM4EALOX12
SCHEMBL3071884 0.83 SLC40A1 (0.55) ALDH1A1ALPLKDM4ELMNAHTT
SCHEMBL3061433 0.82 KMT2A (0.47) ALDH1A1ALPLKDM4ELMNAHTT
SCHEMBL3055969 0.82 ALPL (0.46) ALDH1A1ALPLKDM4ELMNAHTT
SCHEMBL3071425 0.82 KMT2A (0.51) ALDH1A1ALPLKDM4ELMNAHTT
SCHEMBL3061828 0.81 ALPL (0.62) ALDH1A1ALPLKDM4ELMNAHTT
SCHEMBL3072255 0.81 SLC40A1 (0.59) ALDH1A1GAAALPLKDM4ELMNA
SCHEMBL7083753 0.81 ALDH1A1 (0.48) ALDH1A1GAAKDM4ECCR2LMNA
SCHEMBL3066006 0.80 GLO1 (0.54) ALDH1A1ALPLKDM4EKMT2ARAB9A

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
CN-1396833-A Integrin expression inhibitors EISAI CO LTD (JP) 2003-02-12 CN disclosed
EP-1258252-A1 INTEGRIN EXPRESSION INHIBITORS Eisai Co., Ltd. (JP) 2002-11-20 EP 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 (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-20050176712-A1 Integrin expression inhibitor ITGB5, ITGB1, ITGB2 ALDH1A1 1256/4885GAA 4822/4885ALPL 4665/4885
US-20100267754-A1 INTEGRIN EXPRESSION INHIBITOR ITGB5, ITGB1, ITGB2 ALDH1A1 1256/4885GAA 4822/4885ALPL 4665/4885
US-20040018192-A1 Integrin expression inhibitors ITGB1, ITGB4, ITGB5 ALDH1A1 1266/4885GAA 4676/4885ALPL 4722/4885

“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.