SCHEMBL28660741

SCHEMBL28660741

CCCOC(=O)c1ccoc1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.54
LMNA P02545 2/20 0.49
SMN1; SMN2 Q16637 3/20 0.48
KMT2A Q03164 2/20 0.48
RAB9A P51151 2/20 0.48
GAA P10253 2/20 0.48
MEN1 O00255 1/20 0.48
NPC1 O15118 1/20 0.48
HPGD P15428 1/20 0.48
MAOB P27338 1/20 0.46
TSHR P16473 6/20 0.44
TDP1 Q9NUW8 4/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
ESR1 P03372 1/20 0.44
CHRM1 P11229 1/20 0.44
SLC6A2 P23975 1/20 0.44
KDR P35968 1/20 0.44
KDM4E B2RXH2 2/20 0.43
MAPT P10636 1/20 0.43
CYP3A4 P08684 2/20 0.42

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
SCHEMBL28296674 0.91 TSHR (0.57) ALDH1A1LMNASMN1; SMN2RAB9AHPGD
SCHEMBL28381382 0.90 ALDH1A1 (0.58) ALDH1A1LMNASMN1; SMN2KMT2ARAB9A
SCHEMBL28308703 0.88 ALDH1A1 (0.59) ALDH1A1LMNASMN1; SMN2RAB9ANPC1
SCHEMBL15819567 0.87 ALDH1A1 (0.50) ALDH1A1LMNASMN1; SMN2KMT2ARAB9A
SCHEMBL20337837 0.87 TSHR (0.52) ALDH1A1KMT2AGAAMEN1HPGD
SCHEMBL28360318 0.87 TDP1 (0.46) ALDH1A1LMNASMN1; SMN2KMT2ARAB9A
SCHEMBL28654888 0.86 ALDH1A1 (0.53) ALDH1A1LMNASMN1; SMN2KMT2ARAB9A
SCHEMBL28295222 0.86 ALDH1A1 (0.53) ALDH1A1LMNASMN1; SMN2KMT2ARAB9A
SCHEMBL28295220 0.84 TSHR (0.57) ALDH1A1LMNASMN1; SMN2KMT2ARAB9A
SCHEMBL9863067 0.81 TSHR (0.60) ALDH1A1LMNASMN1; SMN2RAB9AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109679300-B Thermoplastic polyester compound and preparation method and product thereof 中国科学院宁波材料技术与工程研究所 2021-11-30 CN disclosed