SCHEMBL4189564

SCHEMBL4189564

CCCCCCCCC(CCCC)OC(=O)c1ccccc1C(=O)O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.75
PRSS1 P07477 1/20 0.53
PRSS2 P07478 1/20 0.53
PRSS3 P35030 1/20 0.53
TSHR P16473 5/20 0.51
LMNA P02545 2/20 0.51
CYP3A4 P08684 3/20 0.49
CA2 P00918 1/20 0.49
MAPK1 P28482 2/20 0.49
TP53 P04637 1/20 0.49
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 1/20 0.47
RECQL P46063 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
PTPN11 Q06124 2/20 0.44
POLB P06746 1/20 0.43
HSD17B10 Q99714 1/20 0.43
PLK1 P53350 1/20 0.41

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
SCHEMBL6401505 1.00 ALDH1A1 (0.75) ALDH1A1PRSS1PRSS2PRSS3TSHR
SCHEMBL6405047 1.00 ALDH1A1 (0.75) ALDH1A1PRSS1PRSS2PRSS3TSHR
SCHEMBL6398621 1.00 ALDH1A1 (0.75) ALDH1A1PRSS1PRSS2PRSS3TSHR
SCHEMBL2696845 1.00 ALDH1A1 (0.75) ALDH1A1PRSS1PRSS2PRSS3TSHR
SCHEMBL6399799 1.00 ALDH1A1 (0.75) ALDH1A1PRSS1PRSS2PRSS3TSHR
SCHEMBL6404665 1.00 ALDH1A1 (0.75) ALDH1A1PRSS1PRSS2PRSS3TSHR
SCHEMBL4181209 1.00 ALDH1A1 (0.75) ALDH1A1PRSS1PRSS2PRSS3TSHR
SCHEMBL271926 1.00 ALDH1A1 (0.75) ALDH1A1PRSS1PRSS2PRSS3TSHR
SCHEMBL6406012 1.00 ALDH1A1 (0.75) ALDH1A1PRSS1PRSS2PRSS3TSHR
SCHEMBL6405092 1.00 ALDH1A1 (0.75) ALDH1A1PRSS1PRSS2PRSS3TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1501830-A1 7-ARYL-3,9-DIAZABICYCLO[3.3.1]NON-6-ENE DERIVATIVES AND THEIR USE AS RENIN INHIBITORS IN THE TREATMENT OF HYPERTENSION, CARDIOVASCULAR OR RENAL DISEASES Actelion Pharmaceuticals Ltd. (CH) 2005-02-02 EP claimed
WO-2003093267-A1 7-ARYL-3,9-DIAZABICYCLO(3.3.1)NON-6-ENE DERIVATIVES AND THEIR USE AS RENIN INHIBITORS IN THE TREATMENT OF HYPERTENSION, CARDIOVASCULAR OR RENAL DISEASES ACTELION PHARMACEUTICALS LTD (CH) 2003-11-13 WO claimed
CN-116981742-A Antifouling coating composition 日东化成株式会社 2023-10-31 CN disclosed
EP-1452865-B1 COMPOSITION FOR BLOOD SERUM OR PLASMA SEPARATION AND VESSEL FOR BLOOD EXAMINATION CONTAINING THE SAME SEKISUI CHEMICAL CO LTD (JP) 2009-02-18 EP disclosed
US-7090970-B2 Composition for blood serum or plasma separation and vessel for blood examination containing the same SEKISUI CHEMICAL CO., LTD. (JP) 2006-08-15 US disclosed
EP-1452865-A1 COMPOSITION FOR BLOOD SERUM OR PLASMA SEPARATION AND VESSEL FOR BLOOD EXAMINATION CONTAINING THE SAME SEKISUI CHEMICAL CO., LTD. (JP) 2004-09-01 EP disclosed
US-20040129631-A1 Composition for blood serum or plasma separation and vessel for blood examination containing the same SEKISUI CHEMICAL CO., LTD. (JP) 2004-07-08 US disclosed