SCHEMBL9366606

SCHEMBL9366606

COc1ccc(OCc2ccccc2)cc1C(O)COc1cccnc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 1/20 0.46
LMNA P02545 2/20 0.46
MAPK1 P28482 3/20 0.45
MAOB P27338 1/20 0.43
MAPT P10636 2/20 0.42
KDM4E B2RXH2 1/20 0.41
ADRA2A P08913 1/20 0.41
ADRA1A P35348 1/20 0.41
PDGFRB P09619 1/20 0.41
PDGFRA P16234 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
HTR1A P08908 1/20 0.41
DRD2 P14416 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GPR132 Q9UNW8 1/20 0.41
ALDH1A1 P00352 1/20 0.41
THRB P10828 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL9367809 0.85 MAOB (0.62) MAPK1MAOBKDM4EADRA2AADRA1A
SCHEMBL9366783 0.84 KDM4E (0.43) MAPK1KDM4EADRA2AADRA1AMEN1
SCHEMBL9366692 0.80 MAPK1 (0.53) LMNAMAPK1MAPTMEN1KMT2A
SCHEMBL9188156 0.79 ADRA2A (0.51) LMNAMAPK1MAOBMAPTKDM4E
SCHEMBL9577526 0.79 GRM5 (0.45) LMNAMAPK1MEN1KMT2AALDH1A1
SCHEMBL9366574 0.77 LRRK2 (0.56) LRRK2LMNAMAPK1MAOBMAPT
SCHEMBL30150593 0.74 RAB9A (0.62) MAPK1MAPTHTR1ADRD2MEN1
SCHEMBL1323646 0.74 RAB9A (0.62) MAPK1MAPTHTR1ADRD2MEN1
SCHEMBL3221735 0.73 MAPT (0.44) LMNAMAPK1MAOBMAPTKDM4E
Bromide SCHEMBL27462942 0.73 RAB9A (0.60) LMNAMAPK1MAPTHTR1ADRD2

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-0391624-B1 Substituted 1-[3-heteroarylmethoxy)phenyl] alkanols and related compounds in the treatment of asthma, arthritis and related diseases PFIZER (US) 1994-04-06 EP disclosed
US-5248685-A Substituted 1-[3-(heteroarylmethoxy)phenyl]alkanols and related compounds in the treatment of asthma PFIZER INC. (US) 1993-09-28 US disclosed
WO-1990012006-A1 SUBSTITUTED 1-[3-(HETEROARYLMETHOXY)PHENYL]ALKANOLS AND RELATED COMPOUNDS IN THE TREATMENT OF ASTHMA, ARTHRITIS AND RELATED DISEASES PFIZER INC. (US) 1990-10-18 WO disclosed
EP-0391624-A1 Substituted 1-[3-heteroarylmethoxy)phenyl] alkanols and related compounds in the treatment of asthma, arthritis and related diseases PFIZER INC. (US) 1990-10-10 EP disclosed