SCHEMBL322219

SCHEMBL322219

N[C@@H](Cc1cc(O)ccc1F)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.57
HSD17B10 Q99714 4/20 0.57
USP2 O75604 3/20 0.57
KDM4E B2RXH2 3/20 0.57
ALDH1A1 P00352 3/20 0.57
KMT2A Q03164 3/20 0.57
CYP3A4 P08684 2/20 0.57
NFKB1 P19838 2/20 0.57
LMNA P02545 2/20 0.57
MAPT P10636 2/20 0.57
BLM P54132 2/20 0.57
PMP22 Q01453 2/20 0.57
NPSR1 Q6W5P4 2/20 0.57
HIF1A Q16665 2/20 0.57
RECQL P46063 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
PKM P14618 2/20 0.57
CYP2C9 P11712 2/20 0.57
MEN1 O00255 2/20 0.57
HPGD P15428 2/20 0.57

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
SCHEMBL15130503 1.00 ALOX15 (0.57) ALOX15HSD17B10USP2KDM4EALDH1A1
SCHEMBL5981375 1.00 ALOX15 (0.57) ALOX15HSD17B10USP2KDM4EALDH1A1
SCHEMBL29897601 1.00 ALOX15 (0.57) ALOX15HSD17B10USP2KDM4EALDH1A1
SCHEMBL15130505 1.00 ALOX15 (0.57) ALOX15HSD17B10USP2KDM4EALDH1A1
SCHEMBL19501942 1.00 ALOX15 (0.57) ALOX15HSD17B10USP2KDM4EALDH1A1
Hydrochloric Acid SCHEMBL6469073 0.98 USP2 (0.56) ALOX15HSD17B10USP2KDM4EALDH1A1
Hydrochloric Acid SCHEMBL6469069 0.98 USP2 (0.56) ALOX15HSD17B10USP2KDM4EALDH1A1
SCHEMBL12375142 0.87 USP2 (0.57) ALOX15HSD17B10USP2KDM4EALDH1A1
SCHEMBL1577675 0.87 USP2 (0.57) ALOX15HSD17B10USP2KDM4EALDH1A1
SCHEMBL751609 0.87 USP2 (0.57) ALOX15HSD17B10USP2KDM4EALDH1A1

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-20170121300-A1 METHOD OF FLUORINATION USING IODONIUM YLIDES THE GENERAL HOSPITAL CORPORATION 2017-05-04 US claimed
US-10259800-B2 Method of fluorination using iodonium ylides THE GENERAL HOSPITAL CORPORATION (US) 2019-04-16 US disclosed
US-20170121300-A1 METHOD OF FLUORINATION USING IODONIUM YLIDES THE GENERAL HOSPITAL CORPORATION 2017-05-04 US disclosed
US-20130190529-A1 Fluorine Radiolabelling Process ISIS INNOVATION LIMITED (GB) 2013-07-25 US disclosed
EP-2590910-A2 FLUORINE RADIOLABELLING PROCESS Isis Innovation Limited (GB) 2013-05-15 EP disclosed
WO-2012004567-A2 FLUORINE RADIOLABELLING PROCESS ISIS INNOVATION LIMITED (GB) 2012-01-12 WO disclosed
WO-2009097144-A1 MOLECULAR PROBES FOR PET-IMAGING OF DOPAMINE NEUROTRANSMISSION AND NEUROENDOCRINE PROCESSES IN VIVO THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2009-08-06 WO disclosed
EP-1979372-A2 METHODS OF LABELING TRANSIENTLY EXPRESSED PROTEINS IN LARGE-SCALE EUKARYOTIC CELL CULTURES Wyeth (US) 2008-10-15 EP disclosed
EP-1658099-B1 COMPOUNDS AND KITS FOR PREPARING IMAGING AGENTS AND METHODS OF IMAGING GEN ELECTRIC (US) 2008-09-10 EP disclosed
WO-2008060307-A2 METHODS OF LABELING TRANSIENTLY EXPRESSED PROTEINS IN LARGE-SCALE EUKARYOTIC CELL CULTURES WYETH (US) 2008-05-22 WO disclosed
US-20070161047-A1 Methods of labeling transiently expressed proteins in large-scale eukaryotic cell cultures WYETH 2007-07-12 US disclosed
US-7115766-B2 Nucleophilic approach for preparing radiolabeled imaging agents and associated compounds INDIANA UNIVERSITY RESEARCH & TECHNOLOGY CORP. (US) 2006-10-03 US disclosed
EP-1658099-A1 COMPOUNDS AND KITS FOR PREPARING IMAGING AGENTS AND METHODS OF IMAGING General Electric Company (US) 2006-05-24 EP disclosed
WO-2005023317-A1 COMPOUNDS AND KITS FOR PREPARING IMAGING AGENTS AND METHODS OF IMAGING GENERAL ELECTRIC COMPANY (US) 2005-03-17 WO disclosed
US-20050049487-A1 Compounds and kits for preparing imaging agents and methods of imaging GENERAL ELECTRIC COMPANY 2005-03-03 US disclosed
US-20040034246-A1 Nucleophilic approach for preparing radiolabeled imaging agents and associated compounds NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2004-02-19 US disclosed
WO-2002044144-A2 NUCLEOPHILIC APPROACH FOR PREPARING RADIOLABELED IMAGING AGENTS AND ASSOCIATED COMPOUNDS ADVANCED RESEARCH AND TECHNOLOGY INSTITUTE, INC. (US) 2002-06-06 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 (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-20170121300-A1 METHOD OF FLUORINATION USING IODONIUM YLIDES FLI1, ABL1, PFAS ALOX15 2398/4885HSD17B10 2666/4885USP2 2636/4885
US-20040034246-A1 Nucleophilic approach for preparing radiolabeled imaging agents and associated compounds SNCA, PARK7, SAMHD1 ALOX15 3001/4885HSD17B10 3891/4885USP2 2339/4885
US-20130190529-A1 Fluorine Radiolabelling Process ESRRG, NR5A2, RXFP4 ALOX15 2478/4885HSD17B10 956/4885USP2 2496/4885
US-10259800-B2 Method of fluorination using iodonium ylides FLI1, ABL1, PFAS ALOX15 2398/4885HSD17B10 2666/4885USP2 2636/4885

“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.