SCHEMBL1996334

SCHEMBL1996334

NC(=O)c1ccccc1OBr

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 1/20 0.60
IRAK4 Q9NWZ3 1/20 0.58
KDM4E B2RXH2 3/20 0.50
MAPT P10636 3/20 0.50
ALDH1A1 P00352 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
PARP1 P09874 2/20 0.50
LMNA P02545 2/20 0.50
HTT P42858 1/20 0.50
GAA P10253 1/20 0.50
NR1I2 O75469 1/20 0.50
CHRM2 P08172 1/20 0.50
CYP3A4 P08684 1/20 0.50
ADRA2A P08913 1/20 0.50
OPRK1 P41145 1/20 0.50
HTR2B P41595 1/20 0.50
SLC6A3 Q01959 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
HPGD P15428 1/20 0.50

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
SCHEMBL29425468 0.83 CTNNB1 (0.60) CTNNB1IRAK4KDM4EMAPTALDH1A1
SCHEMBL7693879 0.82 CTNNB1 (0.77) CTNNB1IRAK4KDM4EMAPTALDH1A1
SCHEMBL7751522 0.82 CTNNB1 (0.70) CTNNB1IRAK4KDM4EMAPTALDH1A1
SCHEMBL1456962 0.80 CTNNB1 (0.62) CTNNB1IRAK4KDM4EMAPTALDH1A1
SCHEMBL5427931 0.80 KDM4E (0.59) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL27379724 0.80 CTNNB1 (0.62) CTNNB1IRAK4KDM4EMAPTALDH1A1
SCHEMBL264288 0.78 IRAK4 (0.63) CTNNB1IRAK4MAPTALDH1A1MEN1
SCHEMBL11852729 0.78 CTNNB1 (0.60) CTNNB1IRAK4KDM4EMAPTALDH1A1
SCHEMBL9457629 0.78 CTNNB1 (0.60) CTNNB1IRAK4KDM4EMAPTALDH1A1
SCHEMBL7671145 0.78 CTNNB1 (0.60) CTNNB1IRAK4KDM4EMAPTALDH1A1

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
CN-1193904-A Personal cleansing kit comprising polymeric diamond-mesh bath sponge and cleaning solution containing halogenated biocide UNILEVER PLC (NL) 1998-09-23 CN claimed
US-20240327442-A1 CONTROLLING METAL-ORGANIC FRAMEWORK MORPHOLOGY THROUGH COORDINATIVE MIMICRY ExxonMobil Technology and Engineering Company 2024-10-03 US disclosed
EP-4380944-A1 CONTROLLING METAL-ORGANIC FRAMEWORK MORPHOLOGY THROUGH COORDINATIVE MIMICRY The Regents of the University of California (US) 2024-06-12 EP disclosed
CN-118076618-A Control of metal-organic framework morphology by coordination modeling 加利福尼亚大学董事会 2024-05-24 CN disclosed
WO-2023014513-A1 CONTROLLING METAL-ORGANIC FRAMEWORK MORPHOLOGY THROUGH COORDINATIVE MIMICRY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-02-09 WO disclosed
US-20110269763-A1 CRTH2 receptor ligands for medicinal uses 7TM PHARMA A/S (DK) 2011-11-03 US disclosed
US-8022063-B2 CRTH2 receptor ligands for medicinal uses 7TM PHARMA A/S (DK) 2011-09-20 US disclosed
EP-2336113-A1 CRTH2 Receptor Ligands for Medical Use 7TM Pharma A/S (DK) 2011-06-22 EP disclosed
US-20090099189-A1 CRTH2 Receptor Ligands For Medicinal Uses 7TM PHARMA A/S (DK) 2009-04-16 US disclosed
EP-1758579-A1 CRTH2 RECEPTOR LIGANDS FOR MEDICINAL USES 7TM Pharma A/S (DK) 2007-03-07 EP disclosed
WO-2005115382-A1 CRTH2 RECEPTOR LIGANDS FOR MEDICINAL USES 7TM PHARMA A/S (DK) 2005-12-08 WO disclosed
CN-1688549-A Compound having TGF-beta inhibitory activity and medicinal composition containing the same KIRIN BREWERY (JP) 2005-10-26 CN disclosed
CN-1222270-C Oral compositions SUNSTAR INC (JP) 2005-10-12 CN disclosed
CN-1204506-A Oral compositions SUNSTAR INC (JP) 1999-01-13 CN disclosed
CN-1193904-A Personal cleansing kit comprising polymeric diamond-mesh bath sponge and cleaning solution containing halogenated biocide UNILEVER PLC (NL) 1998-09-23 CN disclosed
CN-1064013-A The human body foam abluent that contains the foam enhancing polymer PROCTER & GAMBLE (US) 1992-09-02 CN disclosed
CN-1055109-A Cleaning product PROCTER & GAMBLE (US) 1991-10-09 CN 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 (3 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-20240327442-A1 CONTROLLING METAL-ORGANIC FRAMEWORK MORPHOLOGY THROUGH COORDINATIVE MIMICRY TPR, CA4, CA2 CTNNB1 2968/4885IRAK4 1216/4885KDM4E 868/4885
US-20090099189-A1 CRTH2 Receptor Ligands For Medicinal Uses HRH1, HRH2, HRH3 CTNNB1 1396/4885IRAK4 2207/4885KDM4E 4637/4885
US-20110269763-A1 CRTH2 receptor ligands for medicinal uses HRH1, HRH2, HRH4 CTNNB1 1020/4885IRAK4 1860/4885KDM4E 4520/4885

“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.