SCHEMBL8545651

SCHEMBL8545651

CC(=O)C1=Cc2cc(Br)ccc2OC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.55
TP53 P04637 3/20 0.55
LMNA P02545 2/20 0.55
ALOX5 P09917 3/20 0.51
MAOB P27338 5/20 0.47
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
HTT P42858 2/20 0.44
SHMT2 P34897 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
HPGD P15428 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
NR1H4 Q96RI1 1/20 0.41
HSP90AA1 P07900 1/20 0.39
GAA P10253 1/20 0.39
MAOA P21397 1/20 0.39
MTNR1A P48039 1/20 0.39
CCR2 P41597 1/20 0.38

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
SCHEMBL416748 0.86 MAPT (0.56) MAPTTP53LMNAALOX5MAOB
SCHEMBL1758715 0.84 MAPT (0.55) MAPTTP53LMNAALOX5MAOB
SCHEMBL23721431 0.83 MEN1 (0.48) MAPTTP53LMNAALOX5MAOB
SCHEMBL23722813 0.81 MEN1 (0.64) MAPTTP53LMNAALOX5MAOB
SCHEMBL5207946 0.80 MAPT (0.49) MAPTTP53LMNAALOX5MAOB
SCHEMBL5510451 0.80 MAPT (0.55) MAPTTP53LMNAALOX5MAOB
SCHEMBL9058391 0.79 MAOB (0.64) MAPTTP53ALOX5MAOBMEN1
SCHEMBL8543191 0.78 ALOX5 (0.55) MAPTTP53LMNAALOX5MAOB
SCHEMBL27904452 0.78 ALOX5 (0.48) MAPTTP53LMNAALOX5MAOB
SCHEMBL9058393 0.77 ALOX5 (0.67) MAPTTP53LMNAALOX5MAOB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0591046-B1 Chromene derivatives with a triene chain for use in the treatment of osteoporosis inflammatory diseases ADIR (FR) 1998-12-02 EP disclosed
WO-1996020296-A1 USE OF CHROMIUM DERIVATIVES AS BRIGHTENERS BASF AKTIENGESELLSCHAFT (DE) 1996-07-04 WO disclosed
US-5391569-A Treating osteoporosis, inflammatory disorders ADIR ET COMPAGNIE (FR) 1995-02-21 US disclosed
EP-0591046-A1 Chromene derivatives with a triene chain for use in the treatment of osteoporosis inflammatory diseases ADIR ET COMPAGNIE (FR) 1994-04-06 EP disclosed