SCHEMBL14720437

SCHEMBL14720437

C=CC=CC(=O)OP(=O)(O)O

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PEPD P12955 1/20 0.39
CA4 P22748 1/20 0.39
LPAR2 Q9HBW0 1/20 0.32
LPAR3 Q9UBY5 1/20 0.32

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
SCHEMBL23620761 0.87 CA4 (0.43) PEPDCA4
SCHEMBL17848319 0.83
SCHEMBL7701026 0.82 CA4 (0.48) PEPDCA4
SCHEMBL28270632 0.82 CA4 (0.48) PEPDCA4
SCHEMBL7633638 0.77 CA4 (0.36) PEPDCA4
SCHEMBL28051997 0.77 CA4 (0.36) PEPDCA4
SCHEMBL56637 0.77
SCHEMBL9111435 0.76 CA4 (0.34) PEPDCA4
SCHEMBL28523234 0.76 PEPD (0.35) PEPDCA4
SCHEMBL2301184 0.75 PEPD (0.42) PEPDCA4LPAR2LPAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016097289-A1 ENZYMATIC PRODUCTION OF ACRYLYL-COA OR ETHYLENE FROM GLYCEROL GLOBAL BIOENERGIES (FR) 2016-06-23 WO claimed
US-20200385763-A1 MICROORGANISMS AND METHODS FOR PRODUCING 2,4-PENTADIENOATE, BUTADIENE, PROPYLENE, 1,3-BUTANEDIOL AND RELATED ALCOHOLS GENOMATICA INC (US) 2020-12-10 US disclosed
EP-2744906-B1 MICROORGANISMS AND METHODS FOR PRODUCING 2,4-PENTADIENOATE, BUTADIENE, PROPYLENE, 1,3-BUTANEDIOL AND RELATED ALCOHOLS GENOMATICA INC (US) 2019-05-22 EP disclosed
US-20160230195-A1 MICROORGANISMS AND METHODS FOR PRODUCING 2,4-PENTADIENOATE, BUTADIENE, PROPYLENE, 1,3-BUTANEDIOL AND RELATED ALCOHOLS GENOMATICA INC (US) 2016-08-11 US disclosed
WO-2016097289-A1 ENZYMATIC PRODUCTION OF ACRYLYL-COA OR ETHYLENE FROM GLYCEROL GLOBAL BIOENERGIES (FR) 2016-06-23 WO disclosed
EP-2744906-A1 MICROORGANISMS AND METHODS FOR PRODUCING 2,4-PENTADIENOATE, BUTADIENE, PROPYLENE, 1,3-BUTANEDIOL AND RELATED ALCOHOLS Genomatica, Inc. (US) 2014-06-25 EP disclosed
US-20130109064-A1 MICROORGANISMS AND METHODS FOR PRODUCING 2,4-PENTADIENOATE, BUTADIENE, PROPYLENE, 1,3-BUTANEDIOL AND RELATED ALCOHOLS GENOMATICA, INC. 2013-05-02 US disclosed
WO-2013028519-A1 MICROORGANISMS AND METHODS FOR PRODUCING 2,4-PENTADIENOATE, BUTADIENE, PROPYLENE, 1,3-BUTANEDIOL AND RELATED ALCOHOLS GENOMATICA, INC. (US) 2013-02-28 WO disclosed