SCHEMBL4173775

SCHEMBL4173775

CCCCOP(=O)(OCCCC)OP(=O)(O)OP(=O)(O)O.[Nd]

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.57
LPAR3 Q9UBY5 5/20 0.50
LPAR1 Q92633 3/20 0.50
LPAR2 Q9HBW0 3/20 0.50
TSHR P16473 1/20 0.46
BTN3A1 O00481 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
SCHEMBL4183341 0.95 LPAR3 (0.58) CYP3A4LPAR3LPAR1LPAR2TSHR
SCHEMBL4189844 0.93 LPAR3 (0.61) CYP3A4LPAR3LPAR1LPAR2
SCHEMBL9359795 0.93 LPAR3 (0.61) CYP3A4LPAR3LPAR1LPAR2
SCHEMBL2484026 0.93 LPAR3 (0.60) CYP3A4LPAR3LPAR1LPAR2TSHR
SCHEMBL2480132 0.91 LPAR3 (0.63) CYP3A4LPAR3LPAR1LPAR2
SCHEMBL9817835 0.89 LPAR3 (0.61) CYP3A4LPAR3LPAR1LPAR2
SCHEMBL9817795 0.89 LPAR3 (0.61) CYP3A4LPAR3LPAR1LPAR2
SCHEMBL9817809 0.89 LPAR3 (0.61) CYP3A4LPAR3LPAR1LPAR2
SCHEMBL1408422 0.88 CYP3A4 (0.67) CYP3A4LPAR3LPAR1LPAR2TSHR
SCHEMBL28976295 0.88 CYP3A4 (0.52) CYP3A4LPAR3LPAR1LPAR2TSHR

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-20210198386-A1 FUNCTIONALISED POLYBUTADIENE SYNTHESIS PROCESS COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2021-07-01 US disclosed
US-20180016368-A1 PROCESS FOR CONTINUOUS SYNTHESIS OF A DIENE ELASTOMER COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2018-01-18 US disclosed
US-9809661-B2 Process for continuous synthesis of a diene elastomer COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2017-11-07 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-20150158960-A1 PROCESS FOR CONTINUOUS SYTNTHESIS OF A DIENE ELASTOMER MICHELIN RECHERCHE ET TECHNIQUE, S.A. (CH) 2015-06-11 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