SCHEMBL4186753

SCHEMBL4186753

CCCCC(CC)COP(=O)(OCC(CC)CCCC)OP(=O)(O)OP(=O)(O)O.[Nd]

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.66
L3MBTL1 Q9Y468 1/20 0.66
TSHR P16473 2/20 0.42
ATM Q13315 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
LPAR1 Q92633 3/20 0.40
LPAR3 Q9UBY5 3/20 0.40
ALDH1A1 P00352 3/20 0.38
CA2 P00918 2/20 0.38
MMP9 P14780 1/20 0.37
MMP8 P22894 1/20 0.37
MMP14 P50281 1/20 0.37
RECQL P46063 1/20 0.36
FDPS P14324 1/20 0.36
SMPD1 P17405 3/20 0.35
LMNA P02545 1/20 0.35
LPAR2 Q9HBW0 1/20 0.34

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
SCHEMBL4179890 0.98 CYP3A4 (0.68) CYP3A4L3MBTL1TSHRATMTDP1
SCHEMBL1498148 0.97 CYP3A4 (0.66) CYP3A4L3MBTL1TSHRATMTDP1
SCHEMBL28872551 0.92 CYP3A4 (0.72) CYP3A4L3MBTL1TSHRATMTDP1
SCHEMBL8075063 0.91 CYP3A4 (0.74) CYP3A4L3MBTL1TSHRATMTDP1
SCHEMBL1123769 0.89 CYP3A4 (0.72) CYP3A4L3MBTL1TSHRATMTDP1
SCHEMBL10765578 0.89 CYP3A4 (0.72) CYP3A4L3MBTL1TSHRATMTDP1
SCHEMBL852624 0.88 CYP3A4 (0.60) CYP3A4L3MBTL1TSHRATMTDP1
SCHEMBL1123673 0.88 CYP3A4 (0.64) CYP3A4L3MBTL1TSHRATMTDP1
SCHEMBL9353575 0.87 CYP3A4 (0.58) CYP3A4L3MBTL1TSHRATMTDP1
SCHEMBL6313359 0.86 CYP3A4 (0.62) CYP3A4L3MBTL1TSHRATMTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210380728-A1 CONTINUOUS METHOD FOR PRODUCING A DIENE ELASTOMER COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2021-12-09 US disclosed
US-20210198386-A1 FUNCTIONALISED POLYBUTADIENE SYNTHESIS PROCESS COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2021-07-01 US disclosed
US-9056303-B2 Method for the continuous preparation of a catalytic system that is used to polymerize a conjugated diene and installation for implementing same COMPAGNIE GENERALE DES ETABLISSEMENTS (FR) 2015-06-16 US disclosed
US-20090182106-A1 Method for the Continuous Preparation of a Catalytic System that is Used to Polymerize a Conjugated Diene and Installation for Implementing Same MICHELIN RECHERCHE ET TECHNIQUE S.A. (CH) 2009-07-16 US disclosed
US-7396889-B2 Method for preparing a diene elastomer MICHELIN RECHERCHE ET TECHNIQUE S.A. (CH) 2008-07-08 US disclosed
US-20070255029-A1 Method for preparing a diene elastomer MICHELIN RECHERCHE ET TECHNIQUE S.A. 2007-11-01 US disclosed