SCHEMBL7980685

SCHEMBL7980685

COc1cc2c3cc(OC)c(OC)cc3n(S(=O)(=O)c3ccccc3)c2cc1OC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 2/20 0.59
HTR6 P50406 6/20 0.51
PDE4A P27815 2/20 0.48
PDE4B Q07343 2/20 0.48
PDE4C Q08493 2/20 0.48
PDE4D Q08499 2/20 0.48
GAA P10253 1/20 0.48
GFER P55789 1/20 0.48
MTNR1B P49286 1/20 0.46
NOD2 Q9HC29 1/20 0.44
NOD1 Q9Y239 1/20 0.44
POLB P06746 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 2/20 0.43
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL7970608 0.85 SRC (0.50) SRCHTR6PDE4APDE4BPDE4C
SCHEMBL28052552 0.77 ALDH1A1 (0.52) HTR6PDE4APDE4BPDE4CPDE4D
SCHEMBL25748059 0.76 HTR6 (0.60) SRCHTR6PDE4APDE4BPDE4C
SCHEMBL17927644 0.76 HTR6 (0.41) SRCHTR6PDE4APDE4BPDE4C
SCHEMBL7970600 0.75 POLB (0.38) SRCPDE4APDE4BPDE4CPDE4D
SCHEMBL7969684 0.75 SRC (1.00) SRCHTR6NOD1
SCHEMBL20840619 0.74 HTR6 (0.68) HTR6PDE4APDE4BPDE4CPDE4D
SCHEMBL12675368 0.73 SRC (0.63) SRCHTR6NOD1
SCHEMBL10141904 0.72 SRC (0.56) SRCHTR6GAA
SCHEMBL25422879 0.72 MTNR1B (0.55) SRCHTR6PDE4APDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6194439-B1 ANTICANCER AGENT PFIZER INC. 2001-02-27 US disclosed
EP-0586608-A1 TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS PFIZER INC. (US) 1994-03-16 EP disclosed
WO-1992021660-A1 TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS PFIZER, INC. (US) 1992-12-10 WO disclosed