SCHEMBL16795494

SCHEMBL16795494

CC(=O)OP(=O)(O)O.CC(=O)OP(=O)(O)O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA4 P22748 1/20 0.50
PEPD P12955 1/20 0.43
ALDH1A1 P00352 3/20 0.39
TSHR P16473 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
FDPS P14324 1/20 0.39
BLM P54132 1/20 0.39
CA2 P00918 1/20 0.35
LMNA P02545 3/20 0.32
HSD17B10 Q99714 2/20 0.32
PGD P52209 1/20 0.31
MMP2 P08253 1/20 0.30
MMP3 P08254 1/20 0.30
MMP8 P22894 1/20 0.30

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
SCHEMBL49771 1.00
SCHEMBL10597462 0.97 CA4 (0.48) CA4PEPDALDH1A1TSHRTDP1
Phosphoric Acid SCHEMBL16447462 0.97 CA4 (0.48) CA4PEPDALDH1A1TSHRTDP1
Ammonia Solution, Strong SCHEMBL10598792 0.97 CA4 (0.48) CA4PEPDALDH1A1TSHRTDP1
SCHEMBL1677255 0.97
SCHEMBL6246557 0.97 CA4 (0.48) CA4PEPDALDH1A1TSHRTDP1
SCHEMBL6246227 0.97 CA4 (0.48) CA4PEPDALDH1A1TSHRTDP1
Ammonia Solution, Strong SCHEMBL11578534 0.97
SCHEMBL5313172 0.97 CA4 (0.48) CA4PEPDALDH1A1TSHRTDP1
SCHEMBL6246965 0.97 CA4 (0.48) CA4PEPDALDH1A1TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105189772-B Phosphoketolase and phosphate transacetylase produce acetyl-coacetylase derivative compound purposes 阿迈瑞斯公司 2019-09-13 CN disclosed
EP-3080243-B1 USE OF ENZYMES WHICH CATALYZE PYRUVATE SYNTHESIS FROM FORMATE AND ACETYL-COA AND BACTERIA EXPRESSING SAME YEDA RES & DEV (IL) 2018-09-05 EP disclosed
US-10053712-B2 Use of enzymes which catalyze pyruvate synthesis from formate and acetyl-CoA and bacteria expressing same YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2018-08-21 US disclosed
US-20170081682-A1 USE OF ENZYMES WHICH CATALYZE PYRUVATE SYNTHESIS FROM FORMATE AND ACETYL-COA AND BACTERIA EXPRESSING SAME YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2017-03-23 US disclosed
EP-3080243-A1 USE OF ENZYMES WHICH CATALYZE PYRUVATE SYNTHESIS FROM FORMATE AND ACETYL-COA AND BACTERIA EXPRESSING SAME Yeda Research and Development Co., Ltd. (IL) 2016-10-19 EP disclosed
CN-105189772-A Use of phosphoketolase and phosphotransacetylase for production of acetyl-coenzyme a derived compounds AMYRIS INC 2015-12-23 CN disclosed
WO-2015087327-A1 USE OF ENZYMES WHICH CATALYZE PYRUVATE SYNTHESIS FROM FORMATE AND ACETYL-COA AND BACTERIA EXPRESSING SAME YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2015-06-18 WO disclosed