SCHEMBL26908624

SCHEMBL26908624

CC(CO)(CO)CO.COc1cc(C)c(C=O)c(OC)c1C=O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ERN1 O75460 5/20 0.40
▸ ALDH1A1 P00352 2/20 0.36
▸ CYP3A4 P08684 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ CASP1 P29466 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ AKR1B1 P15121 4/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ PRKDC P78527 1/20 0.33
▸ POLB P06746 1/20 0.32
▸ USP2 O75604 1/20 0.32

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
SCHEMBL26908518 0.91 AKR1B1 (0.36) ERN1ALDH1A1CYP3A4KDM4EMEN1
SCHEMBL26908559 0.87 ERN1 (0.44) ERN1ALDH1A1CYP3A4KDM4EMEN1
SCHEMBL29818735 0.86 ERN1 (0.46) ERN1ALDH1A1CYP3A4KDM4EMEN1
SCHEMBL26908604 0.86 LMNA (0.40) ERN1ALDH1A1CYP3A4KDM4EMEN1
SCHEMBL29091962 0.84 ERN1 (0.37) ERN1ALDH1A1CYP3A4KDM4EMEN1
SCHEMBL26908584 0.82 AKR1B1 (0.36) ERN1ALDH1A1CYP3A4KDM4EMEN1
SCHEMBL26908549 0.81 ERN1 (0.33) ERN1ALDH1A1CYP3A4KDM4ETDP1
SCHEMBL26908586 0.77 PRKDC (0.42) ERN1ALDH1A1CYP3A4KDM4EMEN1
SCHEMBL26908535 0.77 CA1 (0.41) ERN1ALDH1A1MAPTAKR1B1
SCHEMBL29091957 0.76 ERN1 (0.46) ERN1ALDH1A1TDP1LMNAPOLB

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
US-20240166867-A1 THERMOPLASTIC RESIN AND OPTICAL LENS INCLUDING SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2024-05-23 — — US disclosed
EP-4286448-A1 THERMOPLASTIC RESIN AND OPTICAL LENS INCLUDING SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2023-12-06 — — EP disclosed
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