SCHEMBL6560149

SCHEMBL6560149

COC(=O)c1cc(OC)nc(OC)c1N

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.51
ALDH1A1 P00352 5/20 0.51
POLB P06746 3/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
HPGD P15428 3/20 0.46
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
GAA P10253 4/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
CYP1A2 P05177 1/20 0.41
NQO2 P16083 2/20 0.40
GLA P06280 1/20 0.40
MAPT P10636 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
ATM Q13315 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL19330152 0.83 ALDH1A1 (0.55) KDM4EALDH1A1POLBL3MBTL1HPGD
SCHEMBL26639879 0.82 KDM4E (0.50) KDM4EALDH1A1POLBHPGDGAA
SCHEMBL30657473 0.82 KDM4E (0.50) KDM4EALDH1A1POLBHPGDGAA
SCHEMBL6559464 0.76 ALDH1A1 (0.51) KDM4EALDH1A1POLBL3MBTL1HPGD
SCHEMBL1901245 0.74 ALDH1A1 (0.47) KDM4EALDH1A1POLBL3MBTL1HPGD
SCHEMBL11605385 0.74 TDP1 (0.71) KDM4EALDH1A1POLBL3MBTL1HPGD
SCHEMBL1514960 0.72 POLB (0.44) KDM4EALDH1A1POLBL3MBTL1HPGD
SCHEMBL143872 0.71 KDM4E (0.46) KDM4EALDH1A1POLBL3MBTL1HPGD
SCHEMBL31264183 0.71 KDM4E (0.46) KDM4EALDH1A1POLBL3MBTL1HPGD
SCHEMBL31582715 0.71 KDM4E (0.54) KDM4EALDH1A1POLBL3MBTL1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1147102-B1 HETEROARYL ACETYLENIC SULFONAMIDE AND PHOSPHINIC ACID AMIDE HYDROXAMIC ACID TACE INHIBITORS WYETH CORP (US) 2004-03-17 EP disclosed
EP-0934300-B1 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO HETEROARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS AMERICAN CYANAMID CO (US) 2002-12-18 EP disclosed
US-20020188132-A1 Heteroaryl acetylenic sulfonamide and phosphinic acid amide hydroxamic acid TACE inhibitors WYETH HOLDINGS CORPORATION 2002-12-12 US disclosed
US-20010051614-A1 Preparation and use of ortho-sulfonamido heteroaryl hydroxamic acids as matrix metalloproteinase and TACE inhibitors LEVIN JEREMY IAN (US) 2001-12-13 US disclosed
EP-1147102-A2 HETEROARYL ACETYLENIC SULFONAMIDE AND PHOSPHINIC ACID AMIDE HYDROXAMIC ACID TACE INHIBITORS American Cyanamid Company (US) 2001-10-24 EP disclosed
US-6200996-B1 ARTHRITIS; BONE, GASTROINTESTINAL DISORDERS; CROHN*S DISEASE, MULTIPLE SCLEROSIS AMERICAN CYANAMID COMPANY 2001-03-13 US disclosed
US-6197795-B1 ANTIARTHRITIC AGENTS; ANTITUMOR AGENTS; WOUND HEALING AGENTS AMERICAN CYANAMID COMPANY 2001-03-06 US disclosed
US-6162814-A Preparation and use of ortho-sulfonamido heteroaryl hydroxamic acids as matrix metaloproteinase and tace inhibitors AMERICAN CYANAMID COMPANY (US) 2000-12-19 US disclosed
US-6162821-A Preparation and use of ortho-sulfonamide heteroarly hydroxamic acids as matrix metalloproteinase and TACE inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 2000-12-19 US disclosed
WO-2000044740-A2 HETEROARYL ACETYLENIC SULFONAMIDE AND PHOSPHINIC ACID AMIDE HYDROXAMIC ACID TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-08-03 WO disclosed
US-5962481-A ANTIARTHRITIC AGENTS; ANTITUMOR AGENTS; WOUND HEALING AGENTS;ANTIULCER AGENTS; ORAL DISEASES; CENTRAL NERVOUS SYTEM DISORDERS; ANTIINFLAMMATORY AGENTS; CONGESTIVE HEART FAILURE;VISION DISORDERS AMERICAN CYANAMID COMPANY (US) 1999-10-05 US disclosed
EP-0934300-A1 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO HETEROARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS American Cyanamid Company (US) 1999-08-11 EP disclosed
WO-1998016520-A1 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO HETEROARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1998-04-23 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-20010051614-A1 Preparation and use of ortho-sulfonamido heteroaryl hydroxamic acids as matrix metalloproteinase and TACE inhibitors MMP1, MMP12, MMP26 KDM4E 4521/4885ALDH1A1 2216/4885POLB 742/4885
US-20020188132-A1 Heteroaryl acetylenic sulfonamide and phosphinic acid amide hydroxamic acid TACE inhibitors TNF, SI, MMP12 KDM4E 4332/4885ALDH1A1 2422/4885POLB 948/4885

“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.