SCHEMBL7769831

SCHEMBL7769831

CC(C)c1c(O)ccc(S(=O)(=O)c2ccc(O)c(C(C)C)c2-c2ccc(O)c(Cl)c2)c1-c1ccc(O)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 3/20 0.39
ESR1 P03372 2/20 0.36
HSD17B1 P14061 3/20 0.34
HSD17B2 P37059 3/20 0.34
DUSP3 P51452 1/20 0.33
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
TYR P14679 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
HDAC2 Q92769 1/20 0.33
AR P10275 1/20 0.33
RIPK2 O43353 1/20 0.33
MELK Q14680 1/20 0.33
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
TYK2 P29597 1/20 0.33

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
SCHEMBL10431081 0.82 USP7 (0.43) ESR2ESR1PTGS1PTGS2
SCHEMBL3316491 0.71 ALKBH3 (0.42) ESR2ESR1HSD17B1HSD17B2HTT
SCHEMBL7078096 0.70 ALDH1A1 (0.41) HSD17B2MEN1KMT2AHSD17B10HDAC2
SCHEMBL10431010 0.70 USP7 (0.43) ESR2ESR1PTGS1
SCHEMBL10431221 0.69 HPGD (0.36) ESR2ESR1TSHRHSD17B10HDAC2
SCHEMBL29023398 0.67 CNR1 (0.42) ESR2HTTCNR1CNR2TYR
SCHEMBL278316 0.66 ESR2 (0.77) ESR2ESR1HSD17B1HSD17B2TSHR
SCHEMBL28202577 0.66 ESR2 (0.77) ESR2ESR1HSD17B1HSD17B2TSHR
SCHEMBL29911026 0.66 ESR2 (0.77) ESR2ESR1HSD17B1HSD17B2TSHR
SCHEMBL11877711 0.66 ESR2 (0.53) ESR2ESR1HSD17B1HSD17B2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0748698-B1 Thermal recording sheet JUJO PAPER CO LTD (JP) 2001-08-22 EP disclosed
US-6184300-B1 USEFUL AS HEAT-INSULATING MATERIAL, ORGANIC PIGMENT, OR OPACIFYING AGENT, AND AS HEAT-INSULATING INTERLAYER TO BE FORMED IN THERMAL RECORDING MATERIAL NIPPON ZEON CO., LTD. (JP) 2001-02-06 US disclosed
US-5747414-A SUBSTRATE WITH COLOR LAYER, ALUMINUM HYDROXIDE AND A RESIN OF UREA-FORMALDEHYDE AND DEVELOPERS NIPPON PAPER INDUSTRIES, LTD. (JP) 1998-05-05 US disclosed
EP-0748698-A2 Thermal recording sheet NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1996-12-18 EP disclosed
EP-0366461-A2 Optical recording medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1990-05-02 EP disclosed