SCHEMBL305009

SCHEMBL305009

NC(=O)c1ccccc1C(=O)NBr

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
ALDH1A1 P00352 3/20 0.50
HPGD P15428 2/20 0.50
MAPT P10636 1/20 0.50
TSHR P16473 1/20 0.50
HSD17B10 Q99714 1/20 0.50
METAP2 P50579 1/20 0.47
SIRT1 Q96EB6 1/20 0.46
BCAT2 O15382 1/20 0.45
NPC1 O15118 2/20 0.43
PDCD1 Q15116 1/20 0.42
CD274 Q9NZQ7 1/20 0.42
GAA P10253 1/20 0.41
CTNNB1 P35222 1/20 0.41
ADRA1D P25100 1/20 0.41
IRAK4 Q9NWZ3 1/20 0.40
CA1 P00915 1/20 0.40
CA9 Q16790 1/20 0.40
RAB9A P51151 1/20 0.40
KEAP1 Q14145 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
SCHEMBL7469914 0.89 ALDH1A1 (0.46) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL17766647 0.82 ALDH1A1 (0.54) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL27700719 0.81 ALDH1A1 (0.70) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL39118 0.81 ALDH1A1 (0.70) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL4967588 0.81 ALDH1A1 (0.70) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL4138337 0.80 CTSD (0.55) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL11337524 0.80 ALDH1A1 (0.64) KDM4EALDH1A1HPGDMAPTGAA
SCHEMBL29872360 0.80 KDM4E (0.59) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL1520940 0.80 KDM4E (0.59) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL4666198 0.78 GAA (0.59) KDM4EALDH1A1HPGDMAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116355155-A Brominated grafting agent and preparation method and application thereof 中国石油天然气股份有限公司 2023-06-30 CN claimed
CN-115141246-A Steroid 17-site side chain protection method and application 天津药业研究院股份有限公司 2022-10-04 CN claimed
CN-111072743-B Synthetic method of loteprednol etabonate intermediate 天津药业研究院股份有限公司 2022-06-14 CN claimed
US-8093391-B2 Process for the preparation of substantially pure palonosetron and its acid salts Sterling Biotech Research Center (IN) 2012-01-10 US claimed
US-20080299161-A1 Solid Biocide Composition and Sealed Biocide Article SANDERSON WILLIAM D 2008-12-04 US claimed
EP-1968380-A2 SOLID BIOCIDE COMPOSITION AND SEALED BIOCIDE ARTICLE Sanderson, William D. (US) 2008-09-17 EP claimed
WO-2007078838-A2 SOLID BIOCIDE COMPOSITION AND SEALED BIOCIDE ARTICLE SANDERSON WILLIAM D (US) 2007-07-12 WO claimed
WO-2006026048-A2 BLEACHING WITH IMPROVED WHITENING THE CLOROX COMPANY (US) 2006-03-09 WO claimed
US-20060046946-A1 Adding to wash water a granule or tablet containing a hypohalite-generating compound, a bromide-releasing compound, a fluorescent whitener; increases the measured textile whitening performance versus a control by a Delta W value of greater than 3.0 THE CLOROX COMPANY 2006-03-02 US claimed
EP-1363516-B1 AN IMPROVED PROCESS FOR PREPARING SIMVASTATIN CHONG KUN DANG PHARM CORP (KR) 2005-08-31 EP claimed
EP-0698080-A4 LAVATORY CLEANING BLOCK BLOCK DRUG CO (US) 1998-07-29 EP claimed
US-5763376-A Lavatory cleaning block BLOCK DRUG COMPANY, INC. (US) 1998-06-09 US claimed
US-5578559-A Lavatory cleaning block BLOCK DRUG COMPANY, INC. (US) 1996-11-26 US claimed
EP-0698080-A1 LAVATORY CLEANING BLOCK BLOCK DRUG COMPANY INC. (US) 1996-02-28 EP claimed
WO-1994026863-A1 LAVATORY CLEANING BLOCK BLOCK DRUG COMPANY, INC. (US) 1994-11-24 WO claimed
CN-116355153-A Brominated grafting agent and preparation method and application thereof 中国石油天然气股份有限公司 2023-06-30 CN disclosed
CN-111072743-B Synthetic method of loteprednol etabonate intermediate 天津药业研究院股份有限公司 2022-06-14 CN disclosed
US-4609731-A Process for brominating ergot alkaloids SANDOZ LTD. (CH) 1986-09-02 US disclosed
US-4009325-A Photodegradable polyolefin composition containing an N-halo urethane THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1977-02-22 US disclosed
US-4000307-A HYPOLIPIDEMIC SANDOZ, INC. (US) 1976-12-28 US disclosed