SCHEMBL7619239

SCHEMBL7619239

CC(C)C(Cc1ccccc1-c1ccccc1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.67
MME P08473 1/20 0.51
ACE P12821 1/20 0.51
CPA1 P15085 1/20 0.51
ACE2 Q9BYF1 1/20 0.51
NR4A2 P43354 1/20 0.49
PTGER1 P34995 1/20 0.46
PTGER4 P35408 1/20 0.46
PTGER3 P43115 1/20 0.46
PTGER2 P43116 1/20 0.46
PPARA Q07869 5/20 0.45
PPARG P37231 2/20 0.45
DPP4 P27487 1/20 0.43
FOLH1 Q04609 1/20 0.43
PDCD1 Q15116 1/20 0.42
CD274 Q9NZQ7 1/20 0.42
KCNA5 P22460 2/20 0.42
KCNH2 Q12809 2/20 0.42
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 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
SCHEMBL7615764 0.87 KMT2A (0.58) KMT2AMMEACECPA1ACE2
SCHEMBL3149585 0.83 KMT2A (0.71) KMT2AMMEACECPA1ACE2
SCHEMBL23189270 0.83 KMT2A (0.71) KMT2AMMEACECPA1ACE2
Bicarbonate SCHEMBL27541289 0.81 KMT2A (0.68) KMT2AMMEACECPA1ACE2
SCHEMBL9148917 0.80 KMT2A (1.00) KMT2AMMEACECPA1ACE2
SCHEMBL6129897 0.78 PPARG (0.50) NR4A2PPARAPPARGSLC6A2SLC6A4
SCHEMBL5610692 0.77 KMT2A (0.61) KMT2AMMEACECPA1ACE2
SCHEMBL5272384 0.77 KMT2A (0.61) KMT2AMMEACECPA1ACE2
SCHEMBL17523029 0.77 NR4A2 (0.43) KMT2AACENR4A2FOLH1
SCHEMBL29238353 0.77 KMT2A (0.67) KMT2AMMEACECPA1ACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0834519-B1 CATALYST FOR POLYOLEFIN PRODUCTION AND PROCESS FOR PRODUCING POLYOLEFIN JAPAN POLYOLEFINS CO LTD (JP) 2002-03-06 EP disclosed
US-6121182-A A METALLOCENE CATALYST FOR POLYMERIZATION OF ISOTACTIC POLYOLEFINS WITH HIGH RIGIDITY AND HIGH MELTING POINT, USEFUL AS INDUSTRIAL MATERIAL FOR AUTOMOBILES JAPAN POLYOLAFINS CO., LTD. (JP) 2000-09-19 US disclosed
EP-0834519-A1 CATALYST FOR POLYOLEFIN PRODUCTION AND PROCESS FOR PRODUCING POLYOLEFIN Japan Polyolefins Co., Ltd. (JP) 1998-04-08 EP disclosed