SCHEMBL4875145

SCHEMBL4875145

CC(=O)Nc1nc(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2)cs1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.51
PIM1 P11309 3/20 0.48
PIM3 Q86V86 3/20 0.48
PIM2 Q9P1W9 1/20 0.46
NAMPT P43490 1/20 0.46
DHFR P00374 3/20 0.44
EGFR P00533 3/20 0.44
LMNA P02545 1/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44
HSD17B10 Q99714 1/20 0.44
HDAC3 O15379 2/20 0.44
HDAC1 Q13547 2/20 0.44
HDAC2 Q92769 2/20 0.44
HDAC10 Q969S8 2/20 0.44
HDAC8 Q9BY41 2/20 0.44
ABCB1 P08183 1/20 0.44
PSMB8 P28062 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 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
SCHEMBL22824735 0.87 ABCB1 (0.43) PIM1PIM3NAMPTEGFRLMNA
SCHEMBL19914270 0.86 TDP1 (0.53) L3MBTL1NAMPTLMNAMAPTHDAC3
SCHEMBL972553 0.84 EGFR (0.43) L3MBTL1PIM1PIM3PIM2DHFR
SCHEMBL972696 0.84 GAA (0.43) L3MBTL1PIM1PIM3NAMPTDHFR
SCHEMBL27626574 0.82 L3MBTL1 (0.63) L3MBTL1PIM1PIM3PIM2DHFR
Hydrochloric Acid SCHEMBL4874159 0.80 L3MBTL1 (0.56) L3MBTL1PIM1PIM3PIM2DHFR
SCHEMBL19914208 0.79 L3MBTL1 (0.44) L3MBTL1HDAC3HDAC1HDAC2HDAC10
SCHEMBL21130623 0.79 L3MBTL1 (0.57) L3MBTL1LMNAKDM4EMAPTHDAC3
SCHEMBL19914394 0.79 IRAK4 (0.53) L3MBTL1LMNAKDM4EMAPTHDAC3
SCHEMBL4687185 0.79 L3MBTL1 (0.50) L3MBTL1HDAC3HDAC1HDAC2HDAC10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1608365-B1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE R TECH UENO LTD (JP) 2013-10-02 EP disclosed
US-7442715-B2 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2008-10-28 US disclosed
US-20080119462-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE SUCAMPO AG (CH) 2008-05-22 US disclosed
US-20060276521-A1 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2006-12-07 US disclosed
US-7125901-B2 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2006-10-24 US disclosed
US-20060229346-A1 Method for treating vascular hyperpermeable disease SUCAMPO AG (CH) 2006-10-12 US disclosed
US-20060128770-A1 Thiazole derivatives FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2006-06-15 US disclosed
EP-1608365-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE Sucampo AG (CH) 2005-12-28 EP disclosed
EP-1587800-A1 THIAZOLE DERIVATIVES AND THEIR USE AS VAP-1 INHIBITORS Astellas Pharma Inc. (JP) 2005-10-26 EP disclosed
US-20040259923-A1 Compound useful as cellular adhesion protein and as antiedemic agent FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2004-12-23 US disclosed
WO-2004087138-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE SUCAMPO AG (CH) 2004-10-14 WO disclosed
WO-2004067521-A1 THIAZOLE DERIVATIVES AND THEIR USE AS VAP-1 INHIBITORS ASTELLAS PHARMA INC. (JP) 2004-08-12 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 (5 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-20080119462-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE VCAM1, ICAM1, VAPB L3MBTL1 3134/4885PIM1 271/4885PIM3 1040/4885
US-20060276521-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 L3MBTL1 537/4885PIM1 184/4885PIM3 704/4885
US-20060229346-A1 Method for treating vascular hyperpermeable disease VCAM1, VAPB, ICAM1 L3MBTL1 2247/4885PIM1 148/4885PIM3 746/4885
US-20060128770-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 L3MBTL1 537/4885PIM1 184/4885PIM3 704/4885
US-20040259923-A1 Compound useful as cellular adhesion protein and as antiedemic agent VCAM1, ICAM1, VAPB L3MBTL1 1469/4885PIM1 582/4885PIM3 1345/4885

“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.