SCHEMBL7107736

SCHEMBL7107736

O=C(Nc1ccc(-c2cccc(O)c2)cc1)c1ccccc1.O=C(Nc1ccc(-c2ccccc2)cc1)c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.72
DEGS1 O15121 1/20 0.71
POLB P06746 2/20 0.60
KDM4E B2RXH2 1/20 0.60
NR1H4 Q96RI1 2/20 0.59
HDAC1 Q13547 2/20 0.59
HDAC2 Q92769 1/20 0.59
PARP1 P09874 1/20 0.58
TRPV1 Q8NER1 1/20 0.57
KCNK3 O14649 1/20 0.57
KCNK9 Q9NPC2 1/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
STAT3 P40763 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
SIRT1 Q96EB6 2/20 0.56
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56

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
SCHEMBL12424027 0.90 PTPN1 (0.82) PTPN1DEGS1POLBKDM4ENR1H4
SCHEMBL7112688 0.87 DEGS1 (0.93) PTPN1DEGS1POLBKDM4ENR1H4
SCHEMBL27760395 0.87 PTPN1 (0.76) PTPN1DEGS1NR1H4HDAC1HDAC2
SCHEMBL10136221 0.87 PTPN1 (0.96) PTPN1DEGS1POLBKDM4ENR1H4
SCHEMBL14160276 0.87 PTPN1 (0.96) PTPN1DEGS1POLBKDM4ENR1H4
SCHEMBL14715946 0.85 PTPN1 (0.79) PTPN1DEGS1POLBNR1H4HDAC1
SCHEMBL18085798 0.85 PTPN1 (1.00) PTPN1DEGS1POLBKDM4ENR1H4
SCHEMBL27984049 0.84 MEN1 (0.74) PTPN1DEGS1POLBNR1H4HDAC1
SCHEMBL8745242 0.84 PTPN1 (0.77) PTPN1DEGS1POLBNR1H4HDAC1
SCHEMBL11877527 0.83 DEGS1 (1.00) PTPN1DEGS1POLBKDM4ENR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6794480-B2 POLYARYLENE-BASED COPOLYMER USEFUL AS PROTON-CONDUCTIVE MEMBRANE WHICH CAN BE USED AS ELECTRON FOR PRIMARY BATTERY, ELECTROLYTE FOR SECONDARY BATTERY, HIGH MOLECULAR SOLID ELECTROLYTE FOR FUEL CELL JSR CORPORATION (JP) 2004-09-21 US disclosed