SCHEMBL8940932

SCHEMBL8940932

CCn1ncc(C(=O)c2ccc3c(c2C)C(OC)CCS3(=O)=O)c1OS(=O)(=O)CC

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL8301862 0.94
SCHEMBL8940922 0.89 NPC1 (0.30) SMN1; SMN2
SCHEMBL8307541 0.89 BDKRB1 (0.32) ALDH1A1GAAHTTSMN1; SMN2
SCHEMBL8618473 0.88
SCHEMBL8613647 0.88 F2 (0.32)
SCHEMBL8128911 0.87
SCHEMBL8462207 0.87
SCHEMBL9039136 0.86
SCHEMBL8303808 0.86 RAB9A (0.31) SMN1; SMN2
SCHEMBL8011989 0.85

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-5587484-A HALOGENATION; OXIDATION; SULFONATION; HERBICIDES IDEMITSU KOSAN CO., LTD. (JP) 1996-12-24 US disclosed