SCHEMBL8778062

SCHEMBL8778062

O=C(Oc1c(CCc2ccccc2)cccc1C(=O)O)c1ccc(O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.51
ESR2 Q92731 2/20 0.51
LMNA P02545 1/20 0.48
SENP1 Q9P0U3 2/20 0.44
DPP4 P27487 2/20 0.42
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 3/20 0.41
UCHL1 P09936 1/20 0.41
USP5 P45974 1/20 0.41
USP4 Q13107 1/20 0.41
ADRB2 P07550 1/20 0.41
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40

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
SCHEMBL8767052 0.88 TSHR (0.51) ESR1ESR2LMNASENP1KMT2A
SCHEMBL8768028 0.86 SENP1 (0.46) ESR1ESR2LMNASENP1KMT2A
SCHEMBL8767097 0.84 SENP1 (0.45) ESR1ESR2LMNASENP1KMT2A
SCHEMBL8768048 0.84 ESR1 (0.46) ESR1ESR2LMNASENP1KMT2A
SCHEMBL8768049 0.81 BID (0.49) ESR1LMNATSHRCYP1A2ALOX15
SCHEMBL8767063 0.81 BID (0.49) ESR1LMNATSHRCYP1A2ALOX15
SCHEMBL8766849 0.81 BID (0.49) ESR1LMNATSHRCYP1A2ALOX15
SCHEMBL7759509 0.80 ESR1 (0.51) ESR1ESR2LMNADPP4KMT2A
SCHEMBL28723635 0.79 ESR1 (0.56) ESR1ESR2LMNADPP4KMT2A
SCHEMBL7759505 0.77 ESR1 (0.54) ESR1ESR2LMNAKMT2AALDH1A1

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-0585127-B1 Thermal Recording sheet JUJO PAPER CO LTD (JP) 1997-12-29 EP disclosed
US-5405821-A Containing a 4-hydroxyphenylarylsulfone color developer NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1995-04-11 US disclosed