SCHEMBL7981059

SCHEMBL7981059

O=c1c2cc(O)c(O)cc2c2cc(O)c(O)cc2n1Cc1ccc(S(=O)(=O)c2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SRC P12931 12/20 1.00
PRKACA P17612 3/20 1.00
PRKACG P22612 3/20 1.00
PRKACB P22694 3/20 1.00
NOX4 Q9NPH5 5/20 0.71
PTGS1 P23219 1/20 0.52
PTGS2 P35354 1/20 0.52
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA9 Q16790 2/20 0.50
ALDH1A1 P00352 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
SCHEMBL9367302 0.87 SRC (1.00) SRCPRKACAPRKACGPRKACBNOX4
SCHEMBL7981604 0.86 SRC (1.00) SRCPRKACAPRKACGPRKACBNOX4
SCHEMBL7987325 0.83 SRC (1.00) SRCPRKACAPRKACGPRKACBNOX4
SCHEMBL7981060 0.83 NOX4 (1.00) SRCPRKACAPRKACGPRKACBNOX4
SCHEMBL7970466 0.82 SRC (0.69) SRCPRKACAPRKACGPRKACBNOX4
SCHEMBL7981707 0.77 SRC (1.00) SRCPRKACAPRKACGPRKACBNOX4
SCHEMBL7983999 0.76 SRC (1.00) SRCPRKACAPRKACGPRKACBNOX4
SCHEMBL7983491 0.74 SRC (1.00) SRCPRKACAPRKACGPRKACBNOX4
SCHEMBL7980552 0.72 SRC (1.00) SRCPRKACAPRKACGPRKACBNOX4
SCHEMBL7983612 0.71 SRC (0.70) SRCPRKACAPRKACGPRKACBNOX4

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