SCHEMBL3065864

SCHEMBL3065864

CC(=O)NCCc1cccc(N)c1

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.57
ALDH1A1 P00352 2/20 0.57
LMNA P02545 1/20 0.57
MAPT P10636 1/20 0.57
HPGD P15428 1/20 0.57
PTGS1 P23219 1/20 0.57
BLM P54132 1/20 0.57
HIF1A Q16665 1/20 0.57
HSD17B10 Q99714 1/20 0.57
F13A1 P00488 1/20 0.53
MTNR1A P48039 4/20 0.52
MTNR1B P49286 4/20 0.52
MAOA P21397 2/20 0.50
MAOB P27338 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.49
CYP19A1 P11511 1/20 0.49
NOX4 Q9NPH5 1/20 0.46

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
SCHEMBL10591303 0.88 KDM4E (0.66) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL16594319 0.86 NOX4 (0.49) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL1027287 0.85 MAOA (0.56) ALDH1A1HPGDMTNR1AMTNR1BMAOA
SCHEMBL2368296 0.83 KIF11 (0.53) KDM4EALDH1A1MAPTHPGDHSD17B10
Hydrochloric Acid SCHEMBL27811543 0.83 MTNR1A (0.65) ALDH1A1HPGDMTNR1AMTNR1BMAOA
SCHEMBL10112805 0.81 HDAC3 (0.59) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL5632567 0.81 SPR (0.66) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL13895358 0.81 KDM4E (0.58) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL6159150 0.80 SMN1; SMN2 (0.66) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL1010819 0.80 TAAR1 (0.62) KDM4EALDH1A1LMNAMAPTHPGD

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 11 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
EP-1243583-B1 HETEROCYCLIC COMPOUNDS HAVING SULFONAMIDE GROUPS EISAI CO LTD (JP) 2005-09-28 EP disclosed
CN-1217936-C Heterocyclic compounds having sulfonic acid EISAI CO LTD (JP) 2005-09-07 CN 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-1414952-A Heterocyclic compounds having sulfonic acid EISAI CO LTD (JP) 2003-04-30 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 (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 KDM4E 2229/4885ALDH1A1 1256/4885LMNA 3673/4885
US-20100267754-A1 INTEGRIN EXPRESSION INHIBITOR ITGB5, ITGB1, ITGB2 KDM4E 2229/4885ALDH1A1 1256/4885LMNA 3673/4885
US-20040018192-A1 Integrin expression inhibitors ITGB1, ITGB4, ITGB5 KDM4E 2279/4885ALDH1A1 1266/4885LMNA 3427/4885
US-20030144507-A1 Sulfonamide-containing heterocyclic compounds SLC5A2, SLC5A1, CBR3 KDM4E 1771/4885ALDH1A1 1018/4885LMNA 3807/4885

“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.