SCHEMBL7981703

SCHEMBL7981703

CS(=O)(=O)c1ccccc1C(=O)n1c2cc(O)c(O)cc2c2c(Br)cc(O)c(O)c21

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SRC P12931 16/20 0.67
PRKACA P17612 12/20 0.67
PRKACG P22612 12/20 0.67
PRKACB P22694 12/20 0.67
LMNA P02545 1/20 0.35
CACNA1B Q00975 2/20 0.34

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
SCHEMBL7970464 0.82 SRC (0.64) SRCPRKACAPRKACGPRKACB
SCHEMBL7980199 0.80 SRC (0.68) SRCPRKACAPRKACGPRKACBLMNA
SCHEMBL7981701 0.80 SRC (1.00) SRCPRKACAPRKACGPRKACB
SCHEMBL7983594 0.76 EED (0.41) SRCPRKACAPRKACGPRKACBLMNA
SCHEMBL7984055 0.76 SRC (1.00) SRCPRKACAPRKACGPRKACB
SCHEMBL7980197 0.72 SRC (1.00) SRCPRKACAPRKACGPRKACB
SCHEMBL7981575 0.72 SRC (0.57) SRCPRKACAPRKACGPRKACB
SCHEMBL7970463 0.61 SRC (1.00) SRCPRKACAPRKACGPRKACB
SCHEMBL7984723 0.60 SRC (1.00) SRCPRKACAPRKACGPRKACB
SCHEMBL4321077 0.60 BCAT2 (0.59) LMNA

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