SCHEMBL9068259

SCHEMBL9068259

BrC/C=C/COc1ccc2c(-c3ccc(Br)cc3)csc2c1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LSS P48449 15/20 0.69
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP2A6 P11509 1/20 0.31
LMNA P02545 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
SCHEMBL8483516 1.00 LSS (0.69) LSSMAPTALDH1A1HSD17B10CYP2A6
SCHEMBL9068957 0.82 LSS (1.00) LSS
SCHEMBL9068958 0.82 LSS (1.00) LSS
SCHEMBL5035264 0.81 LSS (0.62) LSSMAPTALDH1A1HSD17B10
SCHEMBL5039824 0.80 LSS (0.64) LSSMAPTALDH1A1HSD17B10
SCHEMBL8479461 0.79 LSS (0.66) LSSMAPTALDH1A1HSD17B10
SCHEMBL8484297 0.77 LSS (0.60) LSS
SCHEMBL5043116 0.76 LSS (0.54) LSSMAPTALDH1A1HSD17B10LMNA
SCHEMBL8478332 0.76 LSS (0.69) LSS
SCHEMBL8478334 0.76 LSS (0.69) LSS

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-0778271-A2 Aminoalkyl-substituted benzo-heterocyclic compounds F. HOFFMANN-LA ROCHE AG (CH) 1997-06-11 EP disclosed