SCHEMBL7925149

SCHEMBL7925149

Oc1ccccc1Oc1nc(Oc2ccccc2O)nc(Oc2ccccc2O)n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.54
POLB P06746 4/20 0.54
KMT2A Q03164 2/20 0.54
CA2 P00918 2/20 0.50
TP53 P04637 2/20 0.50
CA1 P00915 1/20 0.50
TSHR P16473 1/20 0.50
MAPT P10636 5/20 0.46
LMNA P02545 4/20 0.46
JAK2 O60674 1/20 0.46
ALOX15 P16050 4/20 0.41
HPGD P15428 5/20 0.41
HSD17B10 Q99714 5/20 0.41
ALDH1A1 P00352 3/20 0.41
APEX1 P27695 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 2/20 0.41
CYP3A4 P08684 2/20 0.41
NPC1 O15118 1/20 0.41

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
SCHEMBL19142340 0.88 GAA (0.46) GAAPOLBKMT2ACA2TP53
SCHEMBL5337704 0.82 GAA (0.51) GAAPOLBKMT2ACA2TP53
SCHEMBL29446988 0.82 CA2 (0.62) GAAPOLBKMT2ACA2TP53
SCHEMBL18197 0.82 CA2 (0.62) GAAPOLBKMT2ACA2TP53
SCHEMBL7806601 0.79 CA2 (0.59) GAAPOLBKMT2ACA2TP53
Ammonia Solution, Strong SCHEMBL28322857 0.79 CA2 (0.59) GAAPOLBKMT2ACA2TP53
Phosphine SCHEMBL28067413 0.79 CA2 (0.59) GAAPOLBKMT2ACA2TP53
Methane SCHEMBL11062496 0.79 CA2 (0.59) GAAPOLBKMT2ACA2TP53
SCHEMBL5346421 0.79 GAA (0.49) GAAPOLBKMT2ACA2TP53
SCHEMBL11040381 0.78 HSP90AA1 (0.53) GAAPOLBKMT2ACA2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2961800-B1 FLAME RETARDANT COMPOSITION CANON KK (JP) 2017-07-19 EP disclosed
WO-2007079173-A2 NOVEL 2-HETEROARYLOXY-PHENOL DERIVATIVES AS ANTIBACTERIAL AGENTS EMERGENT BIOSOLUTIONS INC. (US) 2007-07-12 WO disclosed
US-6235819-B1 Process to scavenge amines in polymeric compounds by treatment with triazine derivatives and compositions therefrom BRIDGESTONE CORPORATION (JP) 2001-05-22 US disclosed
US-6063873-A RUBBER TREAD STOCK COMPRISING A VULCANIZABLE COMPOSITION FREE OF METAL REINFORCEMENT, AND A TRIAZINE COMPOUND OF GIVEN FORMULA WHICH ACTS AS AN AMINE SCAVENGER WITHOUT HAVING A DELETERIOUS EFFECT UPON THE VULCANIZABLE COMPOSITION BRIDGESTONE CORPORATION (JP) 2000-05-16 US disclosed
EP-0927740-A2 Process to scavenge amines in polymeric compounds by treatment with triazine derivates, and compositions therefrom Bridgestone Corporation (JP) 1999-07-07 EP disclosed
EP-0927744-A2 Process to scavenge amines in polymeric compounds by treatment with triazine derivates, and compositions therefrom Bridgestone Corporation (JP) 1999-07-07 EP disclosed