SCHEMBL8205804

SCHEMBL8205804

O=C(O)c1ccc(OC(=O)c2cccc(O)c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.61
CA1 P00915 1/20 0.61
CA2 P00918 1/20 0.61
CA6 P23280 1/20 0.61
CA9 Q16790 1/20 0.61
ESR1 P03372 5/20 0.56
ESR2 Q92731 4/20 0.56
KMT2A Q03164 6/20 0.53
MAPT P10636 4/20 0.53
MEN1 O00255 4/20 0.51
TDP1 Q9NUW8 2/20 0.51
PARP10 Q53GL7 1/20 0.51
SLC2A1 P11166 1/20 0.50
SLC2A4 P14672 1/20 0.50
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
KDM4E B2RXH2 1/20 0.49
MITF O75030 1/20 0.49
PKM P14618 1/20 0.49
MAPK1 P28482 1/20 0.49

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
SCHEMBL21681878 0.91 ESR1 (0.65) CA12CA1CA2CA6CA9
SCHEMBL11273083 0.90 PARP10 (0.58) CA1CA2KMT2AMAPTMEN1
SCHEMBL1877874 0.88 ESR1 (0.66) CA12CA1CA2CA6CA9
SCHEMBL9010694 0.88 ESR1 (0.61) CA12CA1CA2CA6CA9
Terephthalic Acid SCHEMBL222545 0.87 ESR1 (0.66) CA12CA1CA2CA6CA9
SCHEMBL21114373 0.87 ESR1 (0.69) CA12CA1CA2CA6CA9
SCHEMBL11040365 0.86 PARP10 (0.59) KMT2AMAPTMEN1TDP1PARP10
SCHEMBL7122242 0.85 KMT2A (0.66) CA12CA1CA2CA6CA9
SCHEMBL9435811 0.85 CA12 (0.53) CA12CA1CA2CA6CA9
SCHEMBL4640725 0.85 ESR1 (0.62) CA12CA1CA2CA6CA9

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
US-4513052-A LEUCO DYE, FLUORAN DYE AND A PHENOLIC COMPOUND RICOH CO., LTD. (JP) 1985-04-23 US claimed
US-6117562-A A THERMAL IMAGE TRANSFER INK LAYER FORMED ON THE SUPPORT; INK LAYER COMPRISING A COLORING AGENT, A RESIN AND A PLASTICIZER FOR LOWERING THE MELT VISCOSITY OF RESIN RICOH COMPANY, LTD. (JP) 2000-09-12 US disclosed
US-5716477-A CONSISTS OF A SUPPORT AND THERMAL IMAGE TRANSFER INK LAYER FORMED ON SAID SUPPORT CONSISTS OF A COLORING AGENT AND A PLASTICIZER FOR LOWERING MELT VISCOSITY OF THE RESIN, HIGH THERMOSENSITIVITY ON CLOTH, PLASTIC, OR PAPER RECEIVER RICOH COMPANY, LTD. (JP) 1998-02-10 US disclosed
US-4562448-A Heat-sensitive transfer medium RICOH CO., LTD. (JP) 1985-12-31 US disclosed
US-4513052-A LEUCO DYE, FLUORAN DYE AND A PHENOLIC COMPOUND RICOH CO., LTD. (JP) 1985-04-23 US disclosed
US-4444844-A LEUCO DYE, SPECIFIC PHENYL BENZOATES AS DEVELOPER AND PROMOTER, FOR HIGH SPEED AND DENSITY RICOH CO., LTD. (JP) 1984-04-24 US disclosed