SCHEMBL3000919

SCHEMBL3000919

CC(=O)Nc1nc(CCc2ccc(CCNC(=N)N)cc2)cs1

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 19/20 0.70
MAOB P27338 3/20 0.67
KMT2A Q03164 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
Hydrochloric Acid SCHEMBL4876217 0.99 AOC3 (0.69) AOC3MAOB
SCHEMBL3932421 0.93 AOC3 (0.68) AOC3MAOBKMT2ASMN1; SMN2
SCHEMBL14365393 0.93 AOC3 (0.67) AOC3MAOBKMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL3932940 0.92 AOC3 (0.66) AOC3MAOBKMT2ASMN1; SMN2
SCHEMBL14188835 0.91 AOC3 (0.73) AOC3MAOBKMT2ASMN1; SMN2
SCHEMBL14019508 0.91 AOC3 (0.70) AOC3MAOBKMT2ASMN1; SMN2
SCHEMBL4890202 0.91 AOC3 (0.73) AOC3MAOBKMT2ASMN1; SMN2
SCHEMBL3939772 0.91 AOC3 (0.70) AOC3MAOBKMT2ASMN1; SMN2
SCHEMBL14365395 0.90 AOC3 (0.64) AOC3MAOBKMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL3931537 0.90 AOC3 (0.71) AOC3MAOBKMT2ASMN1; SMN2

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 44 patents — showing the first 20. 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 claimed
EP-2599498-A1 Composition for ophthalmic disease associated with hypoxia or ischemia R-Tech Ueno, Ltd. (JP) 2013-06-05 EP claimed
US-20100210697-A1 PHARMACEUTICAL COMPOSITION FOR TREATMENT OF CATARACT R-TECH UENO, LTD. (JP) 2010-08-19 US claimed
EP-2213303-A1 PHARMACEUTICAL COMPOSITION FOR TREATMENT OF CATARACT R-Tech Ueno, Ltd. (JP) 2010-08-04 EP claimed
US-20100190834-A1 COMPOSITION FOR OPHTALMIC DISEASE ASSOCIATED WITH HYPOXIA OR ISCHEMIA R-TECH UENO, LTD. (JP) 2010-07-29 US claimed
EP-2172221-A1 COMPOSITION FOR OPHTHALMIC DISEASE ASSOCIATED WITH HYPOXIA OR ISCHEMIA R-Tech Ueno, Ltd. (JP) 2010-04-07 EP claimed
EP-1737450-B1 AQUEOUS COMPOSITION COMPRISING A THIAZOLE DERIVATIVE R TECH UENO LTD (JP) 2009-09-16 EP claimed
US-7442715-B2 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2008-10-28 US claimed
US-20080119462-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE SUCAMPO AG (CH) 2008-05-22 US claimed
US-20070208068-A1 Aqueous Composition Comprising Thiazole Derivative R-TECH UENO, LTD. & ASTELLAS PHARMA INC. 2007-09-06 US claimed
US-20060276521-A1 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2006-12-07 US claimed
US-7125901-B2 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2006-10-24 US claimed
US-20060229346-A1 Method for treating vascular hyperpermeable disease SUCAMPO AG (CH) 2006-10-12 US claimed
US-20040259923-A1 Compound useful as cellular adhesion protein and as antiedemic agent FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2004-12-23 US claimed
US-20160279104-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH ANGIOGENESIS USING A VASCULAR ADHESION PROTEIN-1 (VAP-1) INHIBITOR NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2016-09-29 US disclosed
US-20140170160-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH ANGIOGENESIS USING A VASCULAR ADHESION PROTEIN-1 (VAP-1) INHIBITOR MASSACHUSETTS EYE & EAR INFIRMARY (US) 2014-06-19 US disclosed
EP-1608365-B1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE R TECH UENO LTD (JP) 2013-10-02 EP 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
US-20040259923-A1 Compound useful as cellular adhesion protein and as antiedemic agent FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2004-12-23 US 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 (10 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-20140170160-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH ANGIOGENESIS USING A VASCULAR ADHESION PROTEIN-1 (VAP-1) INHIBITOR VCAM1, VAPB, VAPA AOC3 348/4885MAOB 1629/4885KMT2A 3645/4885
US-20080119462-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE VCAM1, ICAM1, VAPB AOC3 202/4885MAOB 923/4885KMT2A 4255/4885
US-20160279104-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH ANGIOGENESIS USING A VASCULAR ADHESION PROTEIN-1 (VAP-1) INHIBITOR VCAM1, VAPB, VAPA AOC3 348/4885MAOB 1629/4885KMT2A 3645/4885
US-20100190834-A1 COMPOSITION FOR OPHTALMIC DISEASE ASSOCIATED WITH HYPOXIA OR ISCHEMIA VAPB, HIF1AN, OPA1 AOC3 171/4885MAOB 1380/4885KMT2A 4463/4885
US-20060276521-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 AOC3 782/4885MAOB 4191/4885KMT2A 4395/4885
US-20070208068-A1 Aqueous Composition Comprising Thiazole Derivative SLC5A1, SLC5A2, SLC10A1 AOC3 3576/4885MAOB 3792/4885KMT2A 3446/4885
US-20060229346-A1 Method for treating vascular hyperpermeable disease VCAM1, VAPB, ICAM1 AOC3 85/4885MAOB 1422/4885KMT2A 3324/4885
US-20100210697-A1 PHARMACEUTICAL COMPOSITION FOR TREATMENT OF CATARACT OPA1, VAPB, VAPA AOC3 356/4885MAOB 1796/4885KMT2A 4198/4885
US-20060128770-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 AOC3 782/4885MAOB 4191/4885KMT2A 4395/4885
US-20040259923-A1 Compound useful as cellular adhesion protein and as antiedemic agent VCAM1, ICAM1, VAPB AOC3 590/4885MAOB 4111/4885KMT2A 4570/4885

“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.