SCHEMBL6770004

SCHEMBL6770004

COc1ccc(C(=O)NNC(=O)CCl)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.73
L3MBTL1 Q9Y468 1/20 0.73
ALDH1A1 P00352 5/20 0.71
PLAU P00749 1/20 0.64
ELANE P08246 1/20 0.64
MAPT P10636 2/20 0.61
KMT2A Q03164 3/20 0.59
POLB P06746 1/20 0.59
CTDSP1 Q9GZU7 1/20 0.59
HDAC3 O15379 1/20 0.59
HDAC1 Q13547 1/20 0.59
HDAC2 Q92769 1/20 0.59
CA1 P00915 1/20 0.59
CA2 P00918 1/20 0.59
SMN1; SMN2 Q16637 3/20 0.58
HTT P42858 2/20 0.58
GAA P10253 1/20 0.58
CYP2C19 P33261 1/20 0.58
CRHBP P24387 1/20 0.58
CRHR2 Q13324 1/20 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
SCHEMBL11705060 0.86 MAPT (0.79) LMNAL3MBTL1ALDH1A1PLAUELANE
SCHEMBL9703014 0.82 ALDH1A1 (0.79) LMNAL3MBTL1ALDH1A1PLAUELANE
SCHEMBL2635927 0.81 ALDH1A1 (0.70) LMNAALDH1A1MAPTPOLBHDAC1
SCHEMBL5836436 0.81 PLK1 (0.57) LMNAL3MBTL1ALDH1A1MAPTKMT2A
SCHEMBL6765829 0.80 ALDH1A1 (0.61) LMNAL3MBTL1ALDH1A1MAPTKMT2A
SCHEMBL4930245 0.79 MAPT (0.69) LMNAL3MBTL1ALDH1A1PLAUELANE
SCHEMBL6538953 0.79 CA1 (0.81) LMNAL3MBTL1ALDH1A1PLAUELANE
SCHEMBL2636124 0.79 ALDH1A1 (0.59) LMNAL3MBTL1ALDH1A1MAPTKMT2A
SCHEMBL4927732 0.79 GAA (0.75) LMNAL3MBTL1ALDH1A1PLAUELANE
SCHEMBL19899864 0.79 MAPT (0.69) LMNAL3MBTL1ALDH1A1PLAUELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116730941-B 5-Phenyl-1, 3, 4-oxadiazole compound and preparation method and application thereof 广东省科学院微生物研究所(广东省微生物分析检测中心) 2024-07-02 CN disclosed
CN-116730941-A 5-phenyl-1, 3, 4-oxadiazole compound and preparation method and application thereof 广东省科学院微生物研究所(广东省微生物分析检测中心) 2023-09-12 CN disclosed
WO-2005082866-A2 SUBSTITUTED 1, 2, 4- TRIAZOLE DERIVATIVES AS OXYTOCIN ANTAGONISTS PFIZER LIMITED (GB) 2005-09-09 WO disclosed
US-6686353-B1 PREVENTING BLOOD MONOCYTES AND LYMPHOCYTES FROM INFILTRATING TISSUE TEIJIN INTELLECTUAL PROPERTY CENTER LIMITED (JP) 2004-02-03 US disclosed
EP-0914319-B1 DIARYLALKYL CYCLIC DIAMINE DERIVATIVES AS CHEMOKINE RECEPTOR ANTAGONISTS TEIJIN LTD (JP) 2001-11-21 EP disclosed
EP-0914319-A1 DIARYLALKYL CYCLIC DIAMINE DERIVATIVES AS CHEMOKINE RECEPTOR ANTAGONISTS TEIJIN LIMITED (JP) 1999-05-12 EP disclosed
WO-1997044329-A9 DIARYLALKYL CYCLIC DIAMINE DERIVATIVES AS CHEMOKINE RECEPTOR ANTAGONISTS 1998-03-12 WO disclosed
WO-1997044329-A1 DIARYLALKYL CYCLIC DIAMINE DERIVATIVES AS CHEMOKINE RECEPTOR ANTAGONISTS TEIJIN LIMITED (JP) 1997-11-27 WO disclosed