SCHEMBL28347013

SCHEMBL28347013

CCCOC(=O)C1=C(C(=O)O)CCCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
ALDH1A1 P00352 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
MAPT P10636 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CHRM1 P11229 5/20 0.41
CHRM2 P08172 4/20 0.41
CHRM4 P08173 4/20 0.41
CHRM5 P08912 4/20 0.41
CHRM3 P20309 4/20 0.41
SLC6A2 P23975 2/20 0.41
ESR1 P03372 1/20 0.41
TSHR P16473 1/20 0.41
KDR P35968 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HCAR2 Q8TDS4 1/20 0.40
ADORA2B P29275 1/20 0.35
TLR2 O60603 1/20 0.34
KDM4E B2RXH2 2/20 0.34

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
SCHEMBL5607518 0.92 LMNA (0.48) LMNAALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL233683 0.92 ALDH1A1 (0.48) LMNAALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL9863146 0.89 TSHR (0.46) LMNAALDH1A1SMN1; SMN2CHRM1CHRM2
SCHEMBL27208678 0.87 MAPT (0.47) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL28077230 0.86 TSHR (0.49) LMNAALDH1A1MAPTCHRM1CHRM2
SCHEMBL18757016 0.85 DGKA (0.40) LMNAALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL4449462 0.81 TSHR (0.49) LMNAALDH1A1SMN1; SMN2CHRM1CHRM2
SCHEMBL19142555 0.81 SLC6A2 (0.35) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL234625 0.81 TSHR (0.52) LMNAALDH1A1SMN1; SMN2CHRM1CHRM2
SCHEMBL1104058 0.80 MEN1 (0.32) MAPTMEN1KMT2ACHRM1CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111171195-B Propylene polymerization solid catalyst for reducing VOC and method for producing polypropylene using the same 韩华道达尔能源有限公司 2022-12-27 CN disclosed
CN-111171195-A Propylene polymerization solid catalyst for reducing VOC and method for producing polypropylene using the same 韩华道达尔有限公司 2020-05-19 CN disclosed
CN-107207645-B Process for producing olefin polymerization catalyst and process for producing olefin polymer 东邦钛株式会社 2020-01-17 CN disclosed