SCHEMBL30992186

SCHEMBL30992186

CCCCOc1ccc(C(CC(OCC)OCC)(C(=O)OC)c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.44
ALDH1A1 P00352 5/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
MEN1 O00255 5/20 0.44
KMT2A Q03164 5/20 0.44
HTT P42858 2/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
GAA P10253 1/20 0.42
FAAH O00519 3/20 0.41
POLB P06746 1/20 0.41
PPARG P37231 1/20 0.41
PPARD Q03181 1/20 0.41
PPARA Q07869 1/20 0.41
LTA4H P09960 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
SCHEMBL30992196 0.88 KIF11 (0.44) KDM4EALDH1A1SMN1; SMN2LMNATDP1
SCHEMBL30992192 0.88 KCNN4 (0.49) KDM4ESMN1; SMN2LMNAMEN1KMT2A
SCHEMBL30992185 0.84 OPRM1 (0.45) SMN1; SMN2LMNAMEN1KMT2AHTT
SCHEMBL30992202 0.84 KCNN4 (0.43) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL30992190 0.83 OPRM1 (0.46) SMN1; SMN2LMNAMEN1KMT2AHTT
SCHEMBL30992184 0.83 KCNN4 (0.42) KDM4EALDH1A1SMN1; SMN2LMNAMEN1
SCHEMBL30992204 0.83 KCNN4 (0.42) KDM4EALDH1A1SMN1; SMN2LMNATDP1
SCHEMBL30992193 0.79 OPRM1 (0.45) ALDH1A1SMN1; SMN2LMNAMEN1KMT2A
SCHEMBL30992195 0.79 MEN1 (0.37) ALDH1A1SMN1; SMN2TDP1MEN1KMT2A
SCHEMBL30992206 0.77 GRIN2D (0.43) ALDH1A1SMN1; SMN2TDP1MEN1KMT2A

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-118373738-A Method for preparing gamma-aldehyde carboxylic ester by carbon dioxide 常州大学 2024-07-23 CN disclosed