SCHEMBL23786274

SCHEMBL23786274

COC(=O)c1ccc(Nc2nc(Nc3ccc(C(=O)OC)c(O)c3)nc(C(C)S)n2)cc1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ CA12 O43570 3/20 0.47
▸ CA1 P00915 3/20 0.47
▸ CA2 P00918 3/20 0.47
▸ CA7 P43166 3/20 0.47
▸ CA9 Q16790 3/20 0.47
▸ CA14 Q9ULX7 3/20 0.47
▸ PDK2 Q15119 1/20 0.47
▸ PDK4 Q16654 1/20 0.47
▸ GAA P10253 1/20 0.44
▸ EGFR P00533 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ EPHX2 P34913 1/20 0.40
▸ MYC P01106 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ TSHR P16473 1/20 0.39

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
SCHEMBL23139604 0.81 SMN1; SMN2 (0.52) SMN1; SMN2CA12CA1CA2CA7
SCHEMBL27256595 0.77 SMN1; SMN2 (0.48) SMN1; SMN2CA12CA1CA2CA7
SCHEMBL12183416 0.74 EGFR (0.52) SMN1; SMN2CA12CA1CA2CA7
SCHEMBL12727777 0.74 SMN1; SMN2 (0.43) SMN1; SMN2CA12CA1CA2CA7
SCHEMBL12183668 0.73 MAP4K1 (0.43) SMN1; SMN2CA12CA1CA2CA7
SCHEMBL654725 0.72 AURKA (0.57) AURKA
SCHEMBL12183590 0.72 EGFR (0.59) SMN1; SMN2CA12CA1CA2CA7
SCHEMBL7331267 0.71 SMN1; SMN2 (0.70) SMN1; SMN2CA12CA1CA2CA7
SCHEMBL2612061 0.70 EGFR (0.47) SMN1; SMN2CA12CA1CA2CA7
SCHEMBL2127575 0.68 SMN1; SMN2 (1.00) SMN1; SMN2CA12CA1CA2CA7

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
US-20210278761-A1 COLORING PHOTOSENSITIVE COMPOSITION, FILM, COLOR FILTER, SOLID-STATE IMAGING ELEMENT, AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2021-09-09 — — US disclosed
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