SCHEMBL3862940

SCHEMBL3862940

CCC(O)(C(=O)[O-])C(O)C(O)C(O)CO.CCC(O)(C(=O)[O-])C(O)C(O)C(O)CO.CCC(O)(C(=O)[O-])C(O)C(O)C(O)CO.[Y+3]

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.34
PDE4A P27815 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
USP2 O75604 1/20 0.32
SLCO1B1 Q9Y6L6 1/20 0.32
KDM4E B2RXH2 2/20 0.31

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
SCHEMBL6704039 0.96 LMNA (0.40) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL10356240 0.96 LMNA (0.40) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL5559509 0.96 LMNA (0.40) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL2520025 0.96 LMNA (0.40) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL15263244 0.96 LMNA (0.40) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL6700717 0.96 LMNA (0.40) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL4727419 0.96 LMNA (0.44) LMNAL3MBTL1PDE4ATDP1USP2
Potassium Ion SCHEMBL9419063 0.96 LMNA (0.40) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL18103757 0.96 LMNA (0.40) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL15007777 0.96 LMNA (0.40) LMNAL3MBTL1PDE4ATDP1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7595275-B2 Catalyst compositions and their synthesis EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-09-29 US claimed
US-20080045402-A1 Catalyst compositions and their synthesis EXXONMOBIL CHEMICAL PATENTS INC. 2008-02-21 US claimed
US-7595275-B2 Catalyst compositions and their synthesis EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-09-29 US disclosed
US-20080045402-A1 Catalyst compositions and their synthesis EXXONMOBIL CHEMICAL PATENTS INC. 2008-02-21 US disclosed