SCHEMBL22267294

SCHEMBL22267294

C=CC(=O)OCCN1C(=O)C2CCC(C=C(C)C(=O)OCCN3C(=O)C4CCCCC4C3=O)CC2C1=O

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.33
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TP53 P04637 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
SCHEMBL206200 0.82 HTT (0.44) HTTRAB9ASMN1; SMN2TP53
SCHEMBL181720 0.78 HTT (0.39) HTTRAB9ASMN1; SMN2TP53
SCHEMBL7760723 0.78 STAT3 (0.37) HTTRAB9ASMN1; SMN2TP53
SCHEMBL8551817 0.75 ALDH1A1 (0.51) HTTRAB9ASMN1; SMN2TP53
SCHEMBL8552467 0.75 TSHR (0.46) HTTRAB9ASMN1; SMN2TP53
SCHEMBL208342 0.73 HTT (0.43) HTTRAB9ASMN1; SMN2TP53
SCHEMBL19358623 0.70 HTT (0.40) HTTRAB9ASMN1; SMN2TP53
SCHEMBL22164107 0.70 HTT (0.43) HTTRAB9ASMN1; SMN2TP53
SCHEMBL7758884 0.69 LMNA (0.37) HTTRAB9ASMN1; SMN2
SCHEMBL1146670 0.69 ATM (0.43) TP53

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-10723909-B2 Composition and film TOYO GOSEI CO., LTD. (JP) 2020-07-28 US disclosed