SCHEMBL9149221

SCHEMBL9149221

CCOC(=O)c1c(-c2ccccc2Cl)c2cc(C)c(C)cc2oc1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 0.53
ALDH1A1 P00352 6/20 0.51
GRM6 O15303 1/20 0.45
MAPT P10636 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
APAF1 O14727 1/20 0.45
MITF O75030 1/20 0.45
LMNA P02545 1/20 0.45
KDM4E B2RXH2 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
HPGD P15428 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
GLA P06280 1/20 0.42
GAA P10253 1/20 0.42
TDP2 O95551 1/20 0.42
NSD2 O96028 1/20 0.42
PLCG1 P19174 1/20 0.42
PAX8 Q06710 1/20 0.42
TSHR P16473 1/20 0.41
PDE4B Q07343 1/20 0.41

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
SCHEMBL9153220 0.88 ALOX5 (0.58) ALOX5ALDH1A1GRM6MAPTSMN1; SMN2
SCHEMBL8786260 0.81 MAOB (0.54) ALOX5ALDH1A1MAPTSMN1; SMN2APAF1
SCHEMBL6055548 0.80 ALDH1A1 (0.53) ALOX5ALDH1A1GRM6MAPTSMN1; SMN2
SCHEMBL8788590 0.78 CSF1R (0.59) ALOX5ALDH1A1GRM6MAPTSMN1; SMN2
SCHEMBL9157232 0.78 ALOX5 (0.56) ALOX5ALDH1A1SMN1; SMN2LMNAKDM4E
SCHEMBL9138303 0.78 ALDH1A1 (0.48) ALOX5ALDH1A1MAPTSMN1; SMN2APAF1
SCHEMBL9138382 0.78 ALDH1A1 (0.48) ALOX5ALDH1A1MAPTSMN1; SMN2APAF1
SCHEMBL8786825 0.77 MEN1 (0.54) ALOX5ALDH1A1GRM6MAPTSMN1; SMN2
SCHEMBL8785663 0.77 ALOX5 (0.57) ALOX5ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL8784229 0.75 MAOB (0.49) ALOX5ALDH1A1MAPTSMN1; SMN2APAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0514546-B1 CHROMENE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1995-01-04 EP disclosed
US-5278186-A Substituted with secondary amide TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-01-11 US disclosed