SCHEMBL503638

SCHEMBL503638

O=S(=O)(O)c1ccc(O)c(I)c1.[NaH]

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.57
HSD17B10 Q99714 4/20 0.57
KDM4E B2RXH2 1/20 0.52
HPGD P15428 1/20 0.52
LMNA P02545 1/20 0.46
SERPINE1 P05121 3/20 0.44
NT5E P21589 3/20 0.43
CA12 O43570 3/20 0.42
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
CA9 Q16790 2/20 0.42
CA7 P43166 2/20 0.42
CA14 Q9ULX7 2/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA5A P35218 1/20 0.42
CA5B Q9Y2D0 1/20 0.42
TSHR P16473 3/20 0.40
CASP6 P55212 2/20 0.40
NSD2 O96028 1/20 0.40

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
SCHEMBL2298316 0.98 ALDH1A1 (0.59) ALDH1A1HSD17B10KDM4EHPGDLMNA
SCHEMBL6368593 0.82 ALDH1A1 (0.65) ALDH1A1HSD17B10KDM4EHPGDLMNA
SCHEMBL9492667 0.82 ALDH1A1 (0.65) ALDH1A1HSD17B10KDM4EHPGDLMNA
SCHEMBL5097099 0.82 ALDH1A1 (0.65) ALDH1A1HSD17B10KDM4EHPGDLMNA
Water SCHEMBL5097002 0.80 ALDH1A1 (0.63) ALDH1A1HSD17B10KDM4EHPGDLMNA
SCHEMBL29382034 0.80 ALDH1A1 (0.68) ALDH1A1HSD17B10KDM4EHPGDLMNA
SCHEMBL307133 0.80 ALDH1A1 (0.68) ALDH1A1HSD17B10KDM4EHPGDLMNA
SCHEMBL1368815 0.79 ENPP2 (0.50) ALDH1A1HSD17B10LMNASERPINE1CA12
SCHEMBL6391731 0.79 PTPN1 (0.52) ALDH1A1HSD17B10LMNASERPINE1CA12
Ammonia Solution, Strong SCHEMBL2450277 0.78 ALDH1A1 (0.65) ALDH1A1HSD17B10KDM4EHPGDLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6861044-B2 Radioiodinated sulfonated phenols and process therefore THE DOW CHEMICAL COMPANY (US) 2005-03-01 US claimed
EP-1083937-B1 RADIOIOINATED PHENOLS FOR BRACHYTHERAPY DOW GLOBAL TECHNOLOGIES INC (US) 2004-02-11 EP claimed
US-6506364-B1 Administering such as sodium 3-iodo-4-hydroxybenzene sulfonate which is rapidly excreted without significant tissue uptake THE DOW CHEMICAL COMPANY 2003-01-14 US claimed
US-20020081662-A1 Radioiodinated sulfonated phenols and process therefore SIMON JAIME (US) 2002-06-27 US claimed
US-6315979-B1 Radioiodinated sulfonated phenols for brachytherapy THE DOW CHEMICAL COMPANY 2001-11-13 US claimed
EP-1083937-A1 RADIOIOINATED PHENOLS FOR BRACHYTHERAPY THE DOW CHEMICAL COMPANY (US) 2001-03-21 EP claimed
WO-1999062564-A1 RADIOIODINATED PHENOLS FOR BRACHYTHERAPY THE DOW CHEMICAL COMPANY (US) 1999-12-09 WO claimed
US-9498644-B2 Apparatus for brachytherapy BEST MEDICAL INTERNATIONAL, INC. (US) 2016-11-22 US disclosed
US-20150306422-A1 APPARATUS FOR BRACHYTHERAPY BEST MEDICAL INTERNATIONAL, INC. (US) 2015-10-29 US disclosed
US-8709380-B1 Targeting agents for enhancing radiation therapy SIRIUS MEDICINE, LLC (US) 2014-04-29 US disclosed
US-8317673-B2 Device and method for controlling emission of radiation Warsaw Othopedic, Inc. (US) 2012-11-27 US disclosed
US-20120109304-A1 MEDICAL IMPLANT AND METHOD FOR PHOTODYNAMIC THERAPY WARSAW ORTHOPEDIC, INC. (US) 2012-05-03 US disclosed
US-20120029638-A1 VERTEBRAL BODY REPLACEMENT DEVICE CONFIGURED TO DELIVER A THERAPEUTIC SUBSTANCE WARSAW ORTHOPEDIC, INC. (US) 2012-02-02 US disclosed
US-20110270395-A1 DEVICE AND METHOD FOR DELIVERING RADIATION IN SELECTED DIRECTIONS WARSAW ORTHOPEDIC, INC. (US) 2011-11-03 US disclosed
US-20110270012-A1 DEVICE AND METHOD FOR CONTROLLING EMISSION OF RADIATION WARSAW ORTHOPEDIC, INC. (US) 2011-11-03 US disclosed
US-20110264220-A1 DEVICE AND METHOD FOR DELIVERING RADIATION WARSAW ORTHOPEDIC, INC. (US) 2011-10-27 US disclosed
US-20110015741-A1 SPINAL IMPLANT CONFIGURED TO APPLY RADIATION TREATMENT AND METHOD WARSAW ORTHOPEDIC, INC. (US) 2011-01-20 US disclosed
US-20070280418-A1 Coupled Carriers for Enhancing Therapy SIRIUS MEDICINE, LLC (US) 2007-12-06 US disclosed