SCHEMBL28126648

SCHEMBL28126648

CCCOC(=O)C(CCc1ccc(OC)cc1)C(=O)OCCC

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.49
GLA P06280 1/20 0.48
KMT2A Q03164 1/20 0.48
F2RL1 P55085 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
NPC1 O15118 1/20 0.47
MAPT P10636 1/20 0.47
RAB9A P51151 1/20 0.47
ALDH1A1 P00352 3/20 0.46
SLC5A1 P13866 1/20 0.44
SLC5A2 P31639 1/20 0.44
LMNA P02545 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
HTT P42858 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL28132820 0.93 LDHA (0.47) LDHAGLAKMT2AF2RL1SMN1; SMN2
SCHEMBL28126649 0.91 SMN1; SMN2 (0.51) LDHAGLAKMT2AF2RL1SMN1; SMN2
SCHEMBL28126623 0.88 KMT2A (0.57) LDHAGLAKMT2AF2RL1SMN1; SMN2
SCHEMBL28132821 0.84 NPC1 (0.50) LDHAGLAKMT2AF2RL1SMN1; SMN2
SCHEMBL8710489 0.84 KMT2A (0.54) LDHAGLAKMT2AF2RL1SMN1; SMN2
SCHEMBL16732283 0.83 LMNA (0.50) SMN1; SMN2ALDH1A1LMNAL3MBTL1TSHR
SCHEMBL28749624 0.81 LMNA (0.57) KMT2ASMN1; SMN2NPC1MAPTRAB9A
SCHEMBL7055409 0.81 KMT2A (0.54) LDHAGLAKMT2AF2RL1SMN1; SMN2
SCHEMBL28126646 0.80 LDHA (0.68) LDHAF2RL1SMN1; SMN2NPC1RAB9A
SCHEMBL11206752 0.79 TDP1 (0.57) LDHAGLAKMT2AF2RL1MAPT

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
CN-106543312-A A kind of olefin polymerization catalyst system and its application 中国石油化工股份有限公司 2017-03-29 CN claimed
CN-106543314-A The application of catalyst containing ether ester and the catalyst and ether ester in olefinic polyreaction 中国石油化工股份有限公司 2017-03-29 CN claimed
CN-106543313-A A kind of olefin polymerization catalyst system and its application 中国石油化工股份有限公司 2017-03-29 CN claimed
CN-106543310-A A kind of olefin polymerization catalyst system and its application 中国石油化工股份有限公司 2017-03-29 CN claimed
CN-106543312-A A kind of olefin polymerization catalyst system and its application 中国石油化工股份有限公司 2017-03-29 CN disclosed
CN-106543314-A The application of catalyst containing ether ester and the catalyst and ether ester in olefinic polyreaction 中国石油化工股份有限公司 2017-03-29 CN disclosed
CN-106543313-A A kind of olefin polymerization catalyst system and its application 中国石油化工股份有限公司 2017-03-29 CN disclosed
CN-106543310-A A kind of olefin polymerization catalyst system and its application 中国石油化工股份有限公司 2017-03-29 CN disclosed