SCHEMBL22018537

SCHEMBL22018537

C=CCC(Sc1nnc(-c2ccsc2)n1C(=O)OC(C)(C)C)C(N)=O

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.32
ALDH1A1 P00352 3/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32
CHEK2 O96017 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4D Q08499 1/20 0.30

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
SCHEMBL22018968 0.84 ALDH1A1 (0.47) GPR119ALDH1A1SMN1; SMN2MEN1MAPT
SCHEMBL15983351 0.84 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2MEN1MAPTHPGD
SCHEMBL22018974 0.79 TSHR (0.40) ALDH1A1SMN1; SMN2HPGD
SCHEMBL22019642 0.75
SCHEMBL13831476 0.75 RXFP1 (0.34) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A
SCHEMBL13831477 0.73 DGAT1 (0.35) ALDH1A1SMN1; SMN2MAPTHPGDKMT2A
SCHEMBL13831449 0.72 RECQL (0.34) GPR119ALDH1A1SMN1; SMN2MAPTHPGD
SCHEMBL13831963 0.72 PTK2 (0.38) ALDH1A1SMN1; SMN2MEN1MAPTHPGD
SCHEMBL15983347 0.71 TSHR (0.40) ALDH1A1SMN1; SMN2MAPTHPGDKMT2A
SCHEMBL13831472 0.71 GPR119 (0.33) GPR119ALDH1A1SMN1; SMN2

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
EP-3653054-A1 COMPOSITION FOR INHIBITION OF INSECT SENSING Vanderbilt University (US) 2020-05-20 EP disclosed