SCHEMBL27353181

SCHEMBL27353181

Cc1c(OCC(C)NC(=O)OC(C)(C)C)cc(C(=O)NC2CC2)c2c1CCC2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 6/20 0.40
ALDH1A1 P00352 6/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MAPT P10636 3/20 0.36
HSD17B10 Q99714 3/20 0.36
LMNA P02545 2/20 0.36
HPGD P15428 2/20 0.36
TSHR P16473 2/20 0.36
ALOX15 P16050 1/20 0.36
MAPK1 P28482 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
EPHX1 P07099 1/20 0.34
PBK Q96KB5 1/20 0.34
EED O75530 1/20 0.34

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
SCHEMBL30995628 1.00 AAK1 (0.40) AAK1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL27353177 0.86 AAK1 (0.41) AAK1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL30995609 0.84 ALDH1A1 (0.42) AAK1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL27353026 0.84 ALDH1A1 (0.42) AAK1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL30995652 0.82 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AMAPTHPGD
SCHEMBL27353200 0.82 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AMAPTHPGD
Hydrochloric Acid SCHEMBL30995639 0.81 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AMAPTHPGD
SCHEMBL30995617 0.79 ALDH1A1 (0.35) ALDH1A1MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL27353165 0.79 ALDH1A1 (0.35) ALDH1A1MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL27353169 0.79 ALDH1A1 (0.35) ALDH1A1MEN1KMT2ASMN1; SMN2MAPT

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