SCHEMBL29783045

SCHEMBL29783045

CCC(=O)OCN1C(=O)c2ccccc2C1=O

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.62
HPGD P15428 2/20 0.62
CYP1A2 P05177 3/20 0.61
CYP2C19 P33261 3/20 0.61
BLM P54132 1/20 0.61
WRN Q14191 1/20 0.61
HIF1A Q16665 1/20 0.61
CYP3A4 P08684 1/20 0.56
KMT2A Q03164 4/20 0.55
MEN1 O00255 3/20 0.54
TSHR P16473 1/20 0.54
HSD17B10 Q99714 1/20 0.54
GAA P10253 1/20 0.53

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
SCHEMBL19667893 1.00 ALDH1A1 (0.62) ALDH1A1HPGDCYP1A2CYP2C19BLM
SCHEMBL24688014 0.87 CYP1A2 (0.60) ALDH1A1HPGDCYP1A2CYP2C19CYP3A4
SCHEMBL27352834 0.86 CYP1A2 (0.67) ALDH1A1HPGDCYP1A2CYP2C19CYP3A4
SCHEMBL30855594 0.83 CYP1A2 (0.57) ALDH1A1HPGDCYP1A2CYP2C19CYP3A4
SCHEMBL7346924 0.83 CYP1A2 (0.57) ALDH1A1HPGDCYP1A2CYP2C19CYP3A4
SCHEMBL11000826 0.83 ALDH1A1 (0.63) ALDH1A1HPGDKMT2AMEN1TSHR
SCHEMBL29783149 0.82 KMT2A (0.60) ALDH1A1HPGDCYP1A2CYP2C19CYP3A4
SCHEMBL2701523 0.82 KMT2A (0.60) ALDH1A1HPGDCYP1A2CYP2C19CYP3A4
SCHEMBL20717240 0.81 ALDH1A1 (0.57) ALDH1A1HPGDCYP1A2CYP2C19CYP3A4
SCHEMBL29783340 0.81 ALDH1A1 (0.57) ALDH1A1HPGDCYP1A2CYP2C19CYP3A4

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
EP-4288481-A1 PROCESS FOR MODIFYING AN AROMATIC POLYETHER BACKBONE AND A MODIFIED POLYETHER OBTAINED BY THIS PROCESS Technische Universität Berlin (DE) 2023-12-13 EP disclosed
WO-2022167637-A1 PROCESS FOR MODIFYING AN AROMATIC POLYETHER BACKBONE AND A MODIFIED POLYETHER OBTAINED BY THIS PROCESS Technische Universität Berlin (DE) 2022-08-11 WO disclosed