SCHEMBL7981707

SCHEMBL7981707

O=c1c2cc(O)c(O)cc2c2cc(O)c(O)cc2n1Cc1ccc([N+](=O)[O-])cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SRC P12931 10/20 1.00
NOX4 Q9NPH5 5/20 1.00
PRKACA P17612 3/20 1.00
PRKACG P22612 3/20 1.00
PRKACB P22694 3/20 1.00
P2RX4 Q99571 1/20 0.51
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50

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
SCHEMBL7987368 0.86 SRC (1.00) SRCNOX4PRKACAPRKACGPRKACB
SCHEMBL7981572 0.81 NOX4 (0.68) SRCNOX4PRKACAPRKACGPRKACB
SCHEMBL9367302 0.80 SRC (1.00) SRCNOX4PRKACAPRKACGPRKACB
SCHEMBL7983999 0.78 SRC (1.00) SRCNOX4PRKACAPRKACGPRKACB
SCHEMBL7981059 0.77 SRC (1.00) SRCNOX4PRKACAPRKACGPRKACB
SCHEMBL11430833 0.69 SRC (0.53) SRCNOX4PRKACAPRKACGPRKACB
SCHEMBL11421478 0.69 SRC (0.53) SRCNOX4PRKACAPRKACGPRKACB
SCHEMBL7984057 0.69 SRC (1.00) SRCNOX4PRKACAPRKACGPRKACB
SCHEMBL4875253 0.68 KMT2A (0.71) SRCNOX4PRKACAPRKACGPRKACB
SCHEMBL6510739 0.68 KMT2A (0.72) SRCNOX4PRKACAPRKACGPRKACB

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