SCHEMBL28053889

SCHEMBL28053889

O=C(O)CCCCC(=O)OC(=O)c1ccc(C(=O)OCCCCCCCCCCO)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.49
GPR84 Q9NQS5 1/20 0.44
FFAR1 O14842 1/20 0.44
FFAR4 Q5NUL3 1/20 0.44
NPC1 O15118 2/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 1/20 0.43
ALDH1A1 P00352 1/20 0.43
PPARA Q07869 1/20 0.40
LMNA P02545 2/20 0.40
CYP1A2 P05177 2/20 0.40
TSHR P16473 2/20 0.40
CYP2C19 P33261 2/20 0.40
ESR1 P03372 1/20 0.40
CYP2D6 P10635 1/20 0.40
MAPK1 P28482 1/20 0.40
NR1H2 P55055 1/20 0.40
RNASEL Q05823 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL27704742 1.00 TDP1 (0.49) TDP1GPR84FFAR1FFAR4NPC1
SCHEMBL27805204 0.99 TDP1 (0.50) TDP1GPR84FFAR1FFAR4NPC1
SCHEMBL27848753 0.92 TDP1 (0.51) TDP1NPC1MAPTRAB9AALDH1A1
Sebacic Acid SCHEMBL29140855 0.91 TDP1 (0.58) TDP1GPR84FFAR1FFAR4NPC1
SCHEMBL26795349 0.90 TDP1 (0.53) TDP1GPR84FFAR1FFAR4NPC1
Adipic Acid SCHEMBL28427242 0.90 TDP1 (0.59) TDP1GPR84FFAR1FFAR4NPC1
SCHEMBL28189361 0.86 HTT (0.52) TDP1NPC1MAPTRAB9AALDH1A1
SCHEMBL8379024 0.85 MAPK1 (0.49) GPR84FFAR1FFAR4MAPTPPARA
SCHEMBL29154817 0.85 MAPK1 (0.49) GPR84FFAR1FFAR4MAPTPPARA
SCHEMBL26127917 0.85 MAPK1 (0.49) GPR84FFAR1FFAR4MAPTPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105367770-B A kind of aliphatic-aromatic-polylactic-acid block copolymer 中国科学院长春应用化学研究所 2018-06-29 CN disclosed
CN-105367770-A Aliphatic-aromatic-polylactic acid block copolymer CHANGCHUN INST APPLIED CHEMISTRY CAS 2016-03-02 CN disclosed