SCHEMBL134047

SCHEMBL134047

C/[C]=N\OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.46
IDO1 P14902 1/20 0.43
RAB9A P51151 5/20 0.42
NPC1 O15118 4/20 0.42
AGXT P21549 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
GAA P10253 2/20 0.41
ALDH1A1 P00352 2/20 0.41
L3MBTL1 Q9Y468 3/20 0.39
MAPT P10636 2/20 0.39
MAOB P27338 2/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAOA P21397 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
LTA4H P09960 1/20 0.38
TP53 P04637 1/20 0.37
NAAA Q02083 1/20 0.37
USP8 P40818 1/20 0.36

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
SCHEMBL134048 1.00 TSHR (0.46) TSHRIDO1RAB9ANPC1AGXT
SCHEMBL5958151 0.83 TSHR (0.43) TSHRIDO1RAB9ANPC1AGXT
SCHEMBL5958155 0.83 TSHR (0.43) TSHRIDO1RAB9ANPC1AGXT
SCHEMBL17986336 0.81 AGXT (0.48) IDO1RAB9ANPC1AGXTSMN1; SMN2
SCHEMBL17986337 0.81 AGXT (0.48) IDO1RAB9ANPC1AGXTSMN1; SMN2
SCHEMBL17986253 0.79 IDO1 (0.47) IDO1RAB9ANPC1AGXTSMN1; SMN2
SCHEMBL17986270 0.79 IDO1 (0.53) TSHRIDO1AGXTSMN1; SMN2ALDH1A1
SCHEMBL17986271 0.79 IDO1 (0.53) TSHRIDO1AGXTSMN1; SMN2ALDH1A1
SCHEMBL17986275 0.79 IDO1 (0.47) IDO1AGXTALDH1A1L3MBTL1MAOB
SCHEMBL17986276 0.79 IDO1 (0.47) IDO1AGXTALDH1A1L3MBTL1MAOB

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 84 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7700655-B2 Antiallergic agents INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2010-04-20 US claimed
US-20090105292-A9 Glucocorticoid Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2009-04-23 US claimed
US-20080311074-A1 Inhibitors against activation of NF-kappaB INSTITUTE OF MEDICAL MOLECULAR DESIGN INC. (JP) 2008-12-18 US claimed
US-20080234233-A1 MEDICAMENT FOR TREATMENT OF NEURODEGENERATIVE DISEASES INSTITUTE OF MEDICINAL MOLECULAR DESIGN INC. (JP) 2008-09-25 US claimed
US-20080090779-A1 ANTIALLERGIC AGENTS INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2008-04-17 US claimed
US-20070281959-A1 Glucocorticoid receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2007-12-06 US claimed
US-20070185059-A1 Antiallergic agents INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2007-08-09 US claimed
US-20070185110-A1 Antiallergic agents INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2007-08-09 US claimed
US-20070042997-A1 Medicament for treatment of dermal pigmentation INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2007-02-22 US claimed
EP-1718653-A1 GLUCOCORTICOID RECEPTOR MODULATOR COMPOUNDS AND METHODS- UTILITY Ligand Pharmaceuticals Inc. (US) 2006-11-08 EP claimed
EP-1649852-A1 CHROMATOSIS REMEDIES Institute of Medicinal Molecular Design, Inc. (JP) 2006-04-26 EP claimed
WO-2005082909-A1 GLUCOCORTICOID RECEPTOR MODULATOR COMPOUNDS AND METHODS- UTILITY LIGAND PHARMACEUTICALS INCORPORATED (US) 2005-09-09 WO claimed
US-4913722-A HERBICIDES ICI AMERICAS INC. (US) 1990-04-03 US claimed
US-4877880-A REACTING AN N-3-SUBSTITUTED ALLYL ANILINE WITH AN ARYLISOTHIOCYANATE, REACTING THE RESULTANT THIOUREA WITH A (TRIFLUORO-)METHANESULFONIC ACID ICI AMERICAS INC. (US) 1989-10-31 US claimed
EP-0318253-A1 Iminophenylthiazolidines, process of preparation, and method of use ICI AMERICAS INC. (US) 1989-05-31 EP claimed
US-20240065267-A1 PLANT DISEASE CONTROL COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASE BY APPLYING THE SAME MITSUI CHEMICALS CROP & LIFE SOLUTIONS, INC. (JP) 2024-02-29 US disclosed
US-11805779-B2 Plant disease control composition and method for controlling plant disease by applying the same MITSUI CHEMICALS CROP & LIFE SOLUTIONS, INC. (JP) 2023-11-07 US disclosed
US-4877880-A REACTING AN N-3-SUBSTITUTED ALLYL ANILINE WITH AN ARYLISOTHIOCYANATE, REACTING THE RESULTANT THIOUREA WITH A (TRIFLUORO-)METHANESULFONIC ACID ICI AMERICAS INC. (US) 1989-10-31 US disclosed
EP-0318253-A1 Iminophenylthiazolidines, process of preparation, and method of use ICI AMERICAS INC. (US) 1989-05-31 EP disclosed
EP-0318253-A1 Iminophenylthiazolidines, process of preparation, and method of use ICI AMERICAS INC. (US) 1989-05-31 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 (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-20240065267-A1 PLANT DISEASE CONTROL COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASE BY APPLYING THE SAME SNX1, HAX1, BROX TSHR 2603/4885IDO1 1188/4885RAB9A 174/4885
US-20080311074-A1 Inhibitors against activation of NF-kappaB NFKBIA, IKBKB, RELA TSHR 4395/4885IDO1 3169/4885RAB9A 3691/4885
US-20080090779-A1 ANTIALLERGIC AGENTS NAT1, EPX, HRH2 TSHR 3122/4885IDO1 91/4885RAB9A 2827/4885
US-20080234233-A1 MEDICAMENT FOR TREATMENT OF NEURODEGENERATIVE DISEASES MAPT, TFEB, MAOA TSHR 4091/4885IDO1 3097/4885RAB9A 3333/4885
US-11805779-B2 Plant disease control composition and method for controlling plant disease by applying the same SNX1, HAX1, BROX TSHR 2603/4885IDO1 1188/4885RAB9A 174/4885
US-20070185110-A1 Antiallergic agents NAT1, EPX, AHR TSHR 2963/4885IDO1 72/4885RAB9A 2704/4885
US-20090105292-A9 Glucocorticoid Receptor Modulator Compounds and Methods NR3C1, NR3C2, MC2R TSHR 244/4885IDO1 3384/4885RAB9A 3084/4885
US-20070185059-A1 Antiallergic agents NAT1, EPX, AHR TSHR 3004/4885IDO1 80/4885RAB9A 2770/4885
US-20070281959-A1 Glucocorticoid receptor modulator compounds and methods NR3C1, NR3C2, MC2R TSHR 244/4885IDO1 3384/4885RAB9A 3084/4885
US-20070042997-A1 Medicament for treatment of dermal pigmentation TYR, XDH, XPA TSHR 3558/4885IDO1 569/4885RAB9A 3815/4885

“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.