SCHEMBL3587930

SCHEMBL3587930

Cc1nc2ccccc2n1CC(=O)O

nearest known ligand 0.75

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.69
HSD17B10 Q99714 1/20 0.69
LMNA P02545 2/20 0.66
TSHR P16473 1/20 0.66
HTT P42858 1/20 0.66
GSK3B P49841 2/20 0.64
APAF1 O14727 1/20 0.64
APEX1 P27695 1/20 0.63
TNF P01375 1/20 0.61
ALDH1A1 P00352 2/20 0.61
MEN1 O00255 1/20 0.61
KMT2A Q03164 1/20 0.61
ALPL P05186 2/20 0.60
ALPG P10696 2/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
ALPP P05187 1/20 0.60
PLAA Q9Y263 1/20 0.60
TDP1 Q9NUW8 1/20 0.59
PTGDR2 Q9Y5Y4 3/20 0.58

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
SCHEMBL5252741 0.85 LMNA (0.60) LMNATSHRHTTGSK3BAPAF1
SCHEMBL22965263 0.84 LMNA (0.65) KDM4ELMNATSHRHTTGSK3B
SCHEMBL27799061 0.83 KDM4E (0.72) KDM4EHSD17B10APEX1ALDH1A1MEN1
SCHEMBL15360160 0.83 THRB (0.58) LMNATSHRHTTGSK3BAPAF1
SCHEMBL12495433 0.83 ALDH1A1 (0.72) KDM4EHSD17B10LMNATSHRHTT
SCHEMBL12497263 0.83 LMNA (0.69) LMNATSHRHTTGSK3BAPAF1
SCHEMBL14646191 0.82 HSD17B10 (0.94) KDM4EHSD17B10LMNATSHRHTT
SCHEMBL15643888 0.82 HSD17B10 (1.00) KDM4EHSD17B10LMNATSHRAPEX1
SCHEMBL16421959 0.81 KDM4E (0.73) KDM4EHSD17B10LMNATSHRHTT
SCHEMBL28516010 0.81 LMNA (0.62) KDM4ELMNATSHRHTTGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120058616-A 2-Substituted-1H-benzimidazole compound, and preparation method and application thereof 宜昌市中心人民医院(三峡大学第一临床医学院、三峡大学附属中心人民医院) 2025-05-30 CN disclosed
WO-2021023796-A1 COMPOSITIONS FOR TRANSFECTING A NUCLEIC ACID MOLECULE INTO A CELL COMPRISING HETEROCYCLIC COMPOUNDS GRAFTED TO A CATIONIC POLYMER, AND THEIR APPLICATIONS POLYPLUS TRANSFECTION (FR) 2021-02-11 WO disclosed
US-20130216498-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2013-08-22 US disclosed
US-20100286191-A1 2-Arylthiazole Derivatives as CXCR3 Receptor Modulators MERCK SHARP & DOHME CORP. 2010-11-11 US disclosed
US-20090131481-A1 Transcription Factor Modulating Compounds and Methods of Use Thereof PARATEK PHARMACEUTICALS, INC. (US) 2009-05-21 US disclosed
US-20090131481-A1 Transcription Factor Modulating Compounds and Methods of Use Thereof PARATEK PHARMACEUTICALS, INC. (US) 2009-05-21 US disclosed
WO-2009005551-A2 TRANSCRIPTION FACTOR MODULATING COMPOUNDS AND METHODS OF USE THEREOF PARATEK PHARMACEUTICALS, INC. (US) 2009-01-08 WO disclosed
EP-1962605-A2 2-ARYLTHIAZOLE DERIVATIVES AS CXCR3 RECEPTOR MODULATORS Merck & Co., Inc. (US) 2008-09-03 EP disclosed
WO-2007070433-A2 2-ARYLTHIAZOLE DERIVATIVES AS CXCR3 RECEPTOR MODULATORS MERCK & CO., INC. (US) 2007-06-21 WO disclosed
US-20040082079-A1 Low affinity screening method GRAFFINITY PHARMACEUTICALS AG. (DE) 2004-04-29 US disclosed
EP-1360489-A1 LOW AFFINITY SCREENING METHOD Graffinity Pharmaceuticals Aktiengesellschaft (DE) 2003-11-12 EP disclosed
WO-2002063299-A1 LOW AFFINITY SCREENING METHOD GRAFFINITY PHARMACEUTICALS AG (DE) 2002-08-15 WO disclosed
WO-2000066573-A2 OXA COMBINATORIAL LIBRARY, PRODUCTION AND USE THEREOF CEREP (FR) 2000-11-09 WO 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-20090131481-A1 Transcription Factor Modulating Compounds and Methods of Use Thereof CREBBP, JUN, IRF3 KDM4E 500/4885HSD17B10 3699/4885LMNA 3970/4885
US-20130216498-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS JAK1, JAK2, JAK3 KDM4E 883/4885HSD17B10 4084/4885LMNA 4724/4885
US-20100286191-A1 2-Arylthiazole Derivatives as CXCR3 Receptor Modulators CXCR3, CXCR1, CXCR2 KDM4E 3447/4885HSD17B10 1901/4885LMNA 4877/4885

“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.