SCHEMBL2768424

SCHEMBL2768424

CC(C)(C)OC(=O)Nc1ccc(Br)c2cc[nH]c12

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 3/20 0.39
RXFP1 Q9HBX9 2/20 0.36
RAB9A P51151 4/20 0.36
NPC1 O15118 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
RECQL P46063 1/20 0.35
CYP17A1 P05093 1/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA9 Q16790 1/20 0.33
METAP1 P53582 1/20 0.33
MAPT P10636 1/20 0.33
JAK1 P23458 2/20 0.33
JAK2 O60674 1/20 0.33
TYK2 P29597 1/20 0.33
JAK3 P52333 1/20 0.33

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
SCHEMBL23281864 0.89 AAK1 (0.37) AAK1RXFP1RAB9ANPC1SMN1; SMN2
SCHEMBL2768352 0.85 CA12 (0.39) RXFP1RAB9ANPC1SMN1; SMN2MEN1
SCHEMBL29588945 0.84 HSP90AA1 (0.38) RXFP1RAB9ANPC1SMN1; SMN2CYP17A1
SCHEMBL22531782 0.84 HSP90AA1 (0.38) RXFP1RAB9ANPC1SMN1; SMN2CYP17A1
SCHEMBL38664265 0.82 RAB9A (0.34) RXFP1RAB9ANPC1SMN1; SMN2MEN1
SCHEMBL31488142 0.80 RXFP1 (0.57) RXFP1RAB9ANPC1HTTCA1
SCHEMBL25593892 0.78 PTPRC (0.41) AAK1RXFP1RAB9ANPC1SMN1; SMN2
SCHEMBL29901136 0.78 RXFP1 (0.39) RXFP1RAB9ANPC1SMN1; SMN2MEN1
SCHEMBL593484 0.77 RXFP1 (0.62) AAK1RXFP1RAB9ANPC1MEN1
SCHEMBL29926665 0.76 JAK2 (0.46) RXFP1HTTCA12CA1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240174648-A1 Small Molecule Compound TECHNODERMA MEDICINES INC. (CN) 2024-05-30 US disclosed
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
EP-1258252-B1 INTEGRIN EXPRESSION INHIBITORS EISAI R&D MAN CO LTD (JP) 2010-04-21 EP disclosed
CN-100356979-C Integrin expression inhibitors EISAI CO LTD (JP) 2007-12-26 CN disclosed
US-20050176712-A1 Integrin expression inhibitor EISAI CO., LTD. 2005-08-11 US disclosed
US-20040018192-A1 Integrin expression inhibitors EISAI CO., LTD. (JP) 2004-01-29 US disclosed
US-6673787-B2 PYRIMIDINESULFONAMIDE CONTAINING INDOLE COMPOUNDS USED AS ANTIANGIOGENIC AND ANTITUMOR AGENTS EISAI CO., LTD. (JP) 2004-01-06 US disclosed
CN-1132814-C Sulfonamide-containing indole compounds EISAI CO.,LTD. (JP) 2003-12-31 CN disclosed
US-6638964-B2 Pyridinesulfonamide containing indole compounds used as antiangiogenic and antitumor agents EISAI CO., LTD. (JP) 2003-10-28 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
US-6469043-B1 ANTIANGIOGENIC AGENT WITH ANTITUMOR, ANTIMETASTATIC PROPERTIES WHICH SHOWS HIGH SAFETY EISAI CO., LTD. (JP) 2002-10-22 US disclosed
US-20020128483-A1 Sulfonamide-containing indole compounds EISAI CO., LTD. 2002-09-12 US disclosed
US-20020128480-A1 Sulfonamide-containing indole compounds EISAI CO., LTD. 2002-09-12 US disclosed
CN-1294579-A Sulfonamide-containing indole compounds EISAI CO LTD (JP) 2001-05-09 CN disclosed
EP-1074542-A1 SULFONAMIDE-CONTAINING INDOLE COMPOUNDS Eisai Co., Ltd. (JP) 2001-02-07 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 (6 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 AAK1 4043/4885RXFP1 1804/4885RAB9A 1119/4885
US-20020128480-A1 Sulfonamide-containing indole compounds IDO1, HCCS, VEGFA AAK1 1710/4885RXFP1 158/4885RAB9A 2411/4885
US-20240174648-A1 Small Molecule Compound JAK1, JAK2, TYK2 AAK1 224/4885RXFP1 581/4885RAB9A 2519/4885
US-20100267754-A1 INTEGRIN EXPRESSION INHIBITOR ITGB5, ITGB1, ITGB2 AAK1 4043/4885RXFP1 1804/4885RAB9A 1119/4885
US-20020128483-A1 Sulfonamide-containing indole compounds IDO1, HCCS, VEGFA AAK1 1675/4885RXFP1 149/4885RAB9A 2447/4885
US-20040018192-A1 Integrin expression inhibitors ITGB1, ITGB4, ITGB5 AAK1 3895/4885RXFP1 2141/4885RAB9A 1483/4885

“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.