SCHEMBL6473755

SCHEMBL6473755

O=c1[nH]c(OCc2ccccc2)nc2ccccc12

nearest known ligand 0.75

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 2/20 0.75
KMT2A Q03164 1/20 0.56
RAB9A P51151 1/20 0.56
ELANE P08246 1/20 0.56
MAOB P27338 3/20 0.52
HCAR2 Q8TDS4 2/20 0.51
TNKS2 Q9H2K2 5/20 0.50
PARP1 P09874 3/20 0.50
QTRT1 Q9BXR0 1/20 0.50
TNKS O95271 3/20 0.49
MGLL Q99685 1/20 0.48
GUSB P08236 3/20 0.47

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
Hydrochloric Acid SCHEMBL15742407 0.81 KDM4C (0.65) KDM4CKMT2ARAB9AELANETNKS2
SCHEMBL6886533 0.80 TNKS2 (0.56) KDM4CKMT2ARAB9AMAOBHCAR2
SCHEMBL6004217 0.79 TNKS2 (0.51) KDM4CKMT2ARAB9AMAOBHCAR2
SCHEMBL28502323 0.79 HCAR2 (0.53) KDM4CKMT2ARAB9AMAOBHCAR2
SCHEMBL9118233 0.79 GAA (0.53) KDM4CRAB9AELANE
SCHEMBL28503293 0.78 PARP1 (0.59) KDM4CKMT2ARAB9AMAOBHCAR2
SCHEMBL148952 0.77 TNKS2 (0.61) RAB9ATNKS2PARP1QTRT1TNKS
SCHEMBL31070299 0.77 TNKS2 (0.61) RAB9ATNKS2PARP1QTRT1TNKS
SCHEMBL27709478 0.77 KMT2A (0.51) KDM4CKMT2ARAB9AMAOBTNKS2
Hydrochloric Acid SCHEMBL15709417 0.76 TNKS2 (0.59) RAB9ATNKS2PARP1QTRT1TNKS

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
EP-1578755-A1 PHOSPHONOOXY QUINAZOLINE DERIVATIVES AND THEIR PHARMACEUTICAL USE AstraZeneca AB (SE) 2005-09-28 EP disclosed
WO-2004058781-A1 PHOSPHONOOXY QUINAZOLINE DERIVATIVES AND THEIR PHARMACEUTICAL USE ASTRAZENECA AB (SE) 2004-07-15 WO disclosed