SCHEMBL26465353

SCHEMBL26465353

Cc1ccc(F)c(-c2cc(C(=O)N3CCOCC3)ccc2C)c1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.59
GAA P10253 2/20 0.53
ALDH1A1 P00352 3/20 0.53
PLA2G7 Q13093 1/20 0.51
KDM4E B2RXH2 2/20 0.50
PKM P14618 1/20 0.48
PHGDH O43175 1/20 0.48
KMT2A Q03164 2/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
HSP90AA1 P07900 2/20 0.46
HSP90AB1 P08238 2/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46

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
SCHEMBL10194842 0.82 HPGD (0.71) HPGDGAAALDH1A1KDM4EPKM
SCHEMBL13616256 0.82 HPGD (0.67) HPGDGAAALDH1A1KDM4EPKM
SCHEMBL18617226 0.80 HPGD (0.65) HPGDGAAALDH1A1KDM4EPKM
SCHEMBL12311738 0.77 HPGD (0.77) HPGDGAAALDH1A1KDM4EPKM
SCHEMBL256984 0.76 TSHR (0.57) HPGDALDH1A1KDM4EMAPTHTT
SCHEMBL16302094 0.76 HPGD (0.62) HPGDGAAALDH1A1KDM4EPKM
SCHEMBL12871 0.75 PHGDH (0.69) HPGDALDH1A1KDM4EPKMPHGDH
SCHEMBL29588971 0.75 HPGD (0.57) HPGDGAAALDH1A1KDM4EPKM
SCHEMBL18587800 0.75 HPGD (0.57) HPGDGAAALDH1A1KDM4EPKM
SCHEMBL13161947 0.74 HPGD (1.00) HPGDGAAALDH1A1KDM4EPKM

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
WO-2023073115-A1 PROTEIN AGGREGATION INHIBITING COMPOUNDS FOR PLANT DISEASE CONTROL MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2023-05-04 WO disclosed