SCHEMBL4459121

SCHEMBL4459121

O=C(Oc1cccc(O)c1)c1ccc(Cl)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.60
ESR2 Q92731 3/20 0.60
KMT2A Q03164 5/20 0.55
ALOX15 P16050 2/20 0.55
CYP3A4 P08684 1/20 0.54
MAPT P10636 3/20 0.48
CYP2C9 P11712 2/20 0.48
CYP1A2 P05177 1/20 0.48
MEN1 O00255 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HTT P42858 1/20 0.47
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
USP2 O75604 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
GAA P10253 1/20 0.45

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
SCHEMBL688991 0.91 ESR1 (0.70) ESR1ESR2KMT2ACYP3A4MAPT
SCHEMBL10787681 0.88 ESR1 (0.66) ESR1ESR2KMT2ACYP3A4MAPT
SCHEMBL7577334 0.86 KMT2A (0.58) KMT2AALOX15MAPTCYP2C9CYP1A2
SCHEMBL4640725 0.85 ESR1 (0.62) ESR1ESR2KMT2ACYP3A4MAPT
Benzoic Acid 3-Hydroxyphenyl Ester SCHEMBL31650796 0.84 ESR1 (0.71) ESR1ESR2KMT2ACYP3A4MAPT
Benzoic Acid 3-Hydroxyphenyl Ester SCHEMBL78117 0.84 ESR1 (0.71) ESR1ESR2KMT2ACYP3A4MAPT
SCHEMBL11873709 0.83 ALOX15 (0.52) ESR1ESR2KMT2AALOX15MEN1
SCHEMBL689959 0.82 ESR1 (0.78) ESR1ESR2KMT2AALOX15CYP3A4
SCHEMBL10782190 0.82 ESR1 (0.78) ESR1ESR2KMT2ACYP3A4MAPT
SCHEMBL11198376 0.81 ESR1 (0.66) ESR1ESR2KMT2ACYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2397531-B1 Heat-sensitive adhesive material RICOH CO LTD (JP) 2012-10-31 EP disclosed
EP-2014688-B1 Thermosensitive adhesive material RICOH CO LTD (JP) 2012-05-30 EP disclosed
US-20090017299-A1 THERMOSENSITIVE ADHESIVE MATERIAL RICOH COMPANY, LTD (JP) 2009-01-15 US disclosed
EP-2014688-A1 Thermosensitive adhesive material Ricoh Company, Ltd. (JP) 2009-01-14 EP disclosed