SCHEMBL26908509

SCHEMBL26908509

CC(CO)(CO)CO.COc1cc(OC)c(C=O)cc1C=O

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.60
▸ KDM4E B2RXH2 2/20 0.60
▸ TSHR P16473 1/20 0.60
▸ TDP1 Q9NUW8 1/20 0.60
▸ LMNA P02545 2/20 0.45
▸ HPGD P15428 1/20 0.45
▸ ERN1 O75460 8/20 0.42
▸ PRKDC P78527 2/20 0.42
▸ MAPT P10636 3/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ TLR2 O60603 1/20 0.40
▸ TLR1 Q15399 1/20 0.40
▸ TLR6 Q9Y2C9 1/20 0.40
▸ NFE2L2 Q16236 1/20 0.40
▸ GAA P10253 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ CYP3A4 P08684 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38

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
SCHEMBL26908504 0.95 ALDH1A1 (0.62) ALDH1A1KDM4ETSHRTDP1LMNA
SCHEMBL26908616 0.90 ALDH1A1 (0.49) ALDH1A1KDM4ETSHRTDP1LMNA
SCHEMBL26908543 0.87 ALDH1A1 (0.53) ALDH1A1KDM4ETSHRTDP1LMNA
SCHEMBL26908506 0.83 ALDH1A1 (0.56) ALDH1A1KDM4ETSHRTDP1LMNA
SCHEMBL10849623 0.82 ALDH1A1 (0.86) ALDH1A1KDM4ETSHRTDP1LMNA
SCHEMBL26908574 0.82 ALDH1A1 (0.53) ALDH1A1KDM4ETSHRTDP1LMNA
SCHEMBL26908575 0.82 ALDH1A1 (0.53) ALDH1A1KDM4ETSHRTDP1HPGD
SCHEMBL26908527 0.77 ALDH1A1 (0.58) ALDH1A1KDM4ETSHRTDP1LMNA
SCHEMBL29091957 0.76 ERN1 (0.46) ALDH1A1TSHRTDP1LMNAHPGD
Asaraldehyde SCHEMBL29456596 0.76 ALDH1A1 (1.00) ALDH1A1KDM4ETSHRTDP1LMNA

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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