SCHEMBL3055322

SCHEMBL3055322

CC(C)(C)c1ccc(C(=O)Cl)s1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
YEATS4 O95619 1/20 0.54
LMNA P02545 3/20 0.52
TSHR P16473 2/20 0.52
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
RXFP1 Q9HBX9 1/20 0.50
MAPK1 P28482 2/20 0.44
KMT2A Q03164 1/20 0.44
DAO P14920 3/20 0.42
NPSR1 Q6W5P4 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
HPGD P15428 1/20 0.42
ATM Q13315 1/20 0.42
MAPK14 Q16539 1/20 0.38
ERCC5 P28715 1/20 0.35
FEN1 P39748 1/20 0.35
GSK3B P49841 2/20 0.33
F2 P00734 1/20 0.33
KDM4E B2RXH2 2/20 0.33
HTT P42858 2/20 0.33

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
SCHEMBL335624 0.81 DAO (0.64) YEATS4LMNATSHRNPC1RAB9A
SCHEMBL2693481 0.81 LMNA (0.77) YEATS4LMNATSHRNPC1RAB9A
SCHEMBL12321245 0.79 YEATS4 (0.54) YEATS4LMNATSHRNPC1RAB9A
SCHEMBL10293769 0.79 YEATS4 (0.54) YEATS4LMNATSHRNPC1RAB9A
SCHEMBL3060952 0.79 DAO (0.68) YEATS4LMNATSHRNPC1RAB9A
SCHEMBL7649767 0.78 TSHR (0.53) YEATS4LMNATSHRNPC1RAB9A
SCHEMBL12737782 0.78 YEATS4 (0.53) YEATS4LMNATSHRNPC1RAB9A
SCHEMBL996669 0.77 DAO (0.44) LMNATSHRDAOHPGDGSK3B
SCHEMBL10649689 0.76 YEATS4 (0.51) YEATS4LMNATSHRNPC1RAB9A
SCHEMBL668380 0.76 HPGD (0.70) YEATS4LMNATSHRNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210070748-A1 INHIBITORS OF BRUTONS TYROSINE KINASE PHARMACYCLICS LLC (US) 2021-03-11 US disclosed
EP-3008056-B1 NOVEL GLP-1 RECEPTOR MODULATORS CELGENE INT II SARL (CH) 2020-12-09 EP disclosed
EP-3230276-B1 GLP-1 RECEPTOR MODULATORS CELGENE INT II SARL (CH) 2020-09-02 EP disclosed
US-10259823-B2 GLP-1 receptor modulators CELGENE INTERNATIONAL II SÀRL (CH) 2019-04-16 US disclosed
US-20180305348-A1 INHIBITORS OF BRUTONS TYROSINE KINASE PHARMACYCLICS LLC 2018-10-25 US disclosed
US-10034886-B2 GLP-1 receptor modulators CELGENE INTERNATIONAL II SÀRL (CH) 2018-07-31 US disclosed
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2018-01-25 US disclosed
US-20170313717-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2017-11-02 US disclosed
US-9795613-B2 GLP-1 receptor modulators CELGENE INTERNATIONAL II SÀRL (CH) 2017-10-24 US disclosed
US-9598430-B2 GLP-1 receptor modulators CELGENE INTERNATIONAL II SÀRL (CH) 2017-03-21 US disclosed
EP-3008056-A1 NOVEL GLP-1 RECEPTOR MODULATORS Receptos, Inc. (US) 2016-04-20 EP disclosed
US-9260427-B2 GLP-1 receptor modulators RECEPTOS, INC. (US) 2016-02-16 US disclosed
US-20150011527-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2015-01-08 US disclosed
WO-2014201172-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS, INC. (US) 2014-12-18 WO disclosed
US-8541406-B2 Thiadiazole derivatives for the treatment of neurodegenerative diseases NV REMYND (BE) 2013-09-24 US disclosed
US-8357717-B2 Spiro group-containing amide compounds having bradykinin 1 receptor (B1R) activity GRUENENTHAL GMBH (DE) 2013-01-22 US disclosed
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2010-10-14 US disclosed
US-20100234340-A1 Substituted Spiroamide Compounds GRUENENTHAL GMBH (DE) 2010-09-16 US disclosed
US-20090233911-A2 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-09-17 US disclosed
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-02-26 US 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 (11 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-20170313717-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R YEATS4 1269/4885LMNA 2192/4885TSHR 45/4885
US-20210070748-A1 INHIBITORS OF BRUTONS TYROSINE KINASE BTK, LYN, LCK YEATS4 962/4885LMNA 4022/4885TSHR 2430/4885
US-20090233911-A2 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 YEATS4 821/4885LMNA 1113/4885TSHR 3338/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R YEATS4 1269/4885LMNA 2192/4885TSHR 45/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR YEATS4 1085/4885LMNA 1558/4885TSHR 44/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 YEATS4 821/4885LMNA 1113/4885TSHR 3338/4885
US-10259823-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR YEATS4 1085/4885LMNA 1558/4885TSHR 44/4885
US-20180305348-A1 INHIBITORS OF BRUTONS TYROSINE KINASE BTK, LYN, LCK YEATS4 962/4885LMNA 4022/4885TSHR 2430/4885
US-20100234340-A1 Substituted Spiroamide Compounds BDKRB1, BDKRB2, AVPR1B YEATS4 3298/4885LMNA 553/4885TSHR 704/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 YEATS4 821/4885LMNA 1113/4885TSHR 3338/4885
US-20150011527-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R YEATS4 1269/4885LMNA 2192/4885TSHR 45/4885

“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.