SCHEMBL28126649

SCHEMBL28126649

CCCOC(=O)C(CCC)C(=O)OCCc1ccc(OC)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.51
NPC1 O15118 1/20 0.51
MAPT P10636 1/20 0.51
RAB9A P51151 1/20 0.51
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
LDHA P00338 1/20 0.46
GLA P06280 1/20 0.46
KMT2A Q03164 1/20 0.46
F2RL1 P55085 1/20 0.45
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CHRM2 P08172 2/20 0.43
CHRM4 P08173 2/20 0.43
CHRM5 P08912 2/20 0.43
CHRM1 P11229 2/20 0.43
CHRM3 P20309 2/20 0.43
SLC5A1 P13866 1/20 0.43
SLC5A2 P31639 1/20 0.43

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
SCHEMBL28126648 0.91 LDHA (0.49) SMN1; SMN2NPC1MAPTRAB9ALDHA
SCHEMBL28132821 0.87 NPC1 (0.50) SMN1; SMN2NPC1MAPTRAB9ACA1
SCHEMBL28132820 0.84 LDHA (0.47) SMN1; SMN2NPC1MAPTRAB9ALDHA
SCHEMBL28126625 0.81 KMT2A (0.54) SMN1; SMN2NPC1MAPTRAB9ALDHA
SCHEMBL19105279 0.80 CTSK (0.52) SMN1; SMN2NPC1RAB9ACA1CA2
SCHEMBL28126623 0.79 KMT2A (0.57) SMN1; SMN2MAPTLDHAGLAKMT2A
SCHEMBL8710492 0.78 KMT2A (0.50) SMN1; SMN2NPC1MAPTRAB9ALDHA
SCHEMBL490539 0.77 LDHA (0.62) SMN1; SMN2NPC1MAPTRAB9ALDHA
SCHEMBL11206752 0.77 TDP1 (0.57) MAPTLDHAGLAKMT2AF2RL1
SCHEMBL25382081 0.76 SMN1; SMN2 (0.64) SMN1; SMN2NPC1MAPTRAB9ALDHA

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