SCHEMBL196869

SCHEMBL196869

CC(C)OS(=O)(=O)c1cc(Br)ccc1Br

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
EDNRB P24530 2/20 0.38
EDNRA P25101 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TSHR P16473 1/20 0.36
GLA P06280 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GAA P10253 1/20 0.36
HSP90AA1 P07900 1/20 0.35
TLR9 Q9NR96 1/20 0.35
S100A4 P26447 1/20 0.35
PTPRC P08575 1/20 0.35
POLB P06746 2/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
APLNR P35414 2/20 0.34
CTSL P07711 1/20 0.34

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
SCHEMBL196544 0.86 S100A4 (0.39) ALDH1A1MEN1KMT2ANPSR1TSHR
SCHEMBL197324 0.78 ALDH1A1 (0.45) ALDH1A1LMNAMEN1KMT2AEDNRB
SCHEMBL20414679 0.78 CA1 (0.50) KMT2AEDNRBEDNRANPSR1POLB
SCHEMBL27857421 0.77 ALDH1A1 (0.50) ALDH1A1LMNAMEN1KMT2AEDNRB
SCHEMBL18853809 0.73 CA2 (0.45) ALDH1A1LMNACA1CA2
SCHEMBL198462 0.73 NPSR1 (0.43) ALDH1A1LMNAMEN1KMT2AEDNRB
SCHEMBL4157506 0.72 LMNA (0.47) ALDH1A1LMNAMEN1KMT2AEDNRB
SCHEMBL198961 0.72 ALDH1A1 (0.46) ALDH1A1LMNAMEN1KMT2AEDNRB
SCHEMBL11507797 0.71 ALDH1A1 (0.41) ALDH1A1LMNAMEN1KMT2AEDNRB
SCHEMBL20414680 0.71 PGR (0.40) ALDH1A1EDNRBEDNRASMN1; 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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3311136-B1 LONG WAVELENGTH VOLTAGE SENSITIVE DYES UNIV CALIFORNIA (US) 2023-06-07 EP disclosed
US-11169156-B2 Long wavelength voltage sensitive dyes THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-11-09 US disclosed
US-20180209987-A1 LONG WAVELENGTH VOLTAGE SENSITIVE DYES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2018-07-26 US disclosed
US-20180209987-A1 LONG WAVELENGTH VOLTAGE SENSITIVE DYES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2018-07-26 US disclosed
CN-108027314-A Long wavelength's voltage sensitive dye 加利福尼亚大学董事会 2018-05-11 CN disclosed
EP-3311136-A1 LONG WAVELENGTH VOLTAGE SENSITIVE DYES The Regents of The University of California (US) 2018-04-25 EP disclosed
WO-2017019908-A1 LONG WAVELENGTH VOLTAGE SENSITIVE DYES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-02-02 WO disclosed
US-8293905-B2 Bipyridine compound, transition metal complex, and method for production of conjugated aromatic compound using the transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-23 US disclosed
CN-101341183-B Polyarylene and process for producing the same SUMITOMO CO LTD 2012-06-20 CN disclosed
EP-1935916-B1 POLYARYLENE AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL CO (JP) 2012-05-23 EP disclosed
US-20100292481-A1 METHOD FOR PRODUCING CONJUGATED AROMATIC COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED 2010-11-18 US disclosed
EP-2233459-A1 METHOD FOR PRODUCING CONJUGATED AROMATIC COMPOUND Sumitomo Chemical Company, Limited (JP) 2010-09-29 EP disclosed
CN-101827854-A Transition metal complex and method for producing conjugated aromatic compound using same SUMITOMO CHEMICAL CO 2010-09-08 CN disclosed
US-20100184978-A1 BIPYRIDINE COMPOUND, TRANSITION METAL COMPLEX, AND METHOD FOR PRODUCTION OF CONJUGATED AROMATIC COMPOUND USING THE TRANSITION METAL COMPLEX SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-07-22 US disclosed
CN-101772508-A Bipyridine compound, transition metal complex, and method for production of conjugated aromatic compound using the transition metal complex SUMITOMO CHEMICAL CO 2010-07-07 CN disclosed
EP-2192124-A1 TRANSITION METAL COMPLEX AND PROCESS FOR PRODUCING CONJUGATED AROMATIC COMPOUND WITH THE TRANSITION METAL COMPLEX Sumitomo Chemical Company, Limited (JP) 2010-06-02 EP disclosed
EP-2172470-A1 BIPYRIDINE COMPOUND, TRANSITION METAL COMPLEX, AND METHOD FOR PRODUCTION OF CONJUGATED AROMATIC COMPOUND USING THE TRANSITION METAL COMPLEX Sumitomo Chemical Company, Limited (JP) 2010-04-07 EP disclosed
CN-101341183-A Polyarylene and process for producing the same SUMITOMO CHEMICAL CO (JP) 2009-01-07 CN disclosed
US-20080287646-A1 Polyarylene and Method for Producing the Same SUMITOMO CHEMICAL COMPANY, LIMITED 2008-11-20 US disclosed
EP-1935916-A1 POLYARYLENE AND PROCESS FOR PRODUCING THE SAME Sumitomo Chemical Company, Limited (JP) 2008-06-25 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 (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-20100184978-A1 BIPYRIDINE COMPOUND, TRANSITION METAL COMPLEX, AND METHOD FOR PRODUCTION OF CONJUGATED AROMATIC COMPOUND USING THE TRANSITION METAL COMPLEX C9, C5, AP2M1 ALDH1A1 1092/4885LMNA 3345/4885MEN1 371/4885
US-20180209987-A1 LONG WAVELENGTH VOLTAGE SENSITIVE DYES KCNN1, KCNN2, KCNN3 ALDH1A1 986/4885LMNA 930/4885MEN1 2857/4885
US-20080287646-A1 Polyarylene and Method for Producing the Same CYP1A1, C1R, CBR1 ALDH1A1 602/4885LMNA 2889/4885MEN1 246/4885
US-20100292481-A1 METHOD FOR PRODUCING CONJUGATED AROMATIC COMPOUND TYR, PAH, AHR ALDH1A1 816/4885LMNA 2021/4885MEN1 332/4885
US-11169156-B2 Long wavelength voltage sensitive dyes KCNN1, KCNN2, KCNN3 ALDH1A1 986/4885LMNA 930/4885MEN1 2857/4885

“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.