SCHEMBL27353177

SCHEMBL27353177

Cc1c(OC[C@H](C)NC(=O)OC(C)(C)C)cc(C(=O)O)c2c1CCC2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 6/20 0.41
ALDH1A1 P00352 6/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HSD17B10 Q99714 4/20 0.37
HPGD P15428 3/20 0.37
MAPT P10636 3/20 0.37
LMNA P02545 2/20 0.37
TSHR P16473 2/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KDM4E B2RXH2 3/20 0.37
GLA P06280 2/20 0.37
GAA P10253 2/20 0.37
CASP1 P29466 1/20 0.37
RAB9A P51151 1/20 0.37
CASP7 P55210 1/20 0.37
CYP1A2 P05177 1/20 0.36

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
SCHEMBL30995609 0.90 ALDH1A1 (0.42) AAK1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL27353026 0.90 ALDH1A1 (0.42) AAK1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL30995628 0.86 AAK1 (0.40) AAK1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL27353181 0.86 AAK1 (0.40) AAK1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL27353173 0.83 ALDH1A1 (0.39) ALDH1A1MEN1KMT2ALMNATSHR
SCHEMBL30995605 0.81 AAK1 (0.37) AAK1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL30995622 0.78 RXRA (0.35) ALDH1A1MEN1KMT2ALMNATSHR
SCHEMBL27353047 0.78 RXRA (0.35) ALDH1A1MEN1KMT2ALMNATSHR
SCHEMBL8459351 0.75 MTNR1A (0.45) AAK1ALDH1A1KMT2AHSD17B10HPGD
SCHEMBL25155742 0.74 AAK1 (0.43) AAK1ALDH1A1HSD17B10HPGDKDM4E

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-2024126650-A1 NOVEL BICYCLIC-CARBOXAMIDE COMPOUNDS USEFUL AS PESTICIDES SYNGENTA CROP PROTECTION AG (CH) 2024-06-20 WO disclosed