Zinc Ion

Zinc Ion

SCHEMBL7090677

CC(C)(c1ccccc1)c1cc(C(=O)[O-])c(O)c(-c2ccccc2)c1.CC(C)(c1ccccc1)c1cc(C(=O)[O-])c(O)c(-c2ccccc2)c1.[Zn+2]

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.44
AKR1C3 P42330 1/20 0.42
AKR1C2 P52895 1/20 0.42
AKR1C1 Q04828 1/20 0.42
CNR1 P21554 4/20 0.42
CNR2 P34972 4/20 0.42
PTPN6 P29350 2/20 0.41
PTPN2 P17706 1/20 0.41
ESR1 P03372 2/20 0.40
ESR2 Q92731 2/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP3A4 P08684 1/20 0.40
HNF4A P41235 1/20 0.40
IKBKB O14920 1/20 0.38
CHUK O15111 1/20 0.38
PKLR P30613 1/20 0.37
TACR1 P25103 1/20 0.34
NR3C2 P08235 1/20 0.34
BACE1 P56817 2/20 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
SCHEMBL11776523 0.97 PTPN1 (0.44) PTPN1AKR1C3AKR1C2AKR1C1CNR1
Zinc Ion SCHEMBL11341982 0.96 ESR1 (0.42) PTPN1AKR1C3AKR1C2AKR1C1CNR1
SCHEMBL313198 0.87 PTPN1 (0.59) PTPN1AKR1C3AKR1C2AKR1C1CNR1
SCHEMBL7090683 0.86 PTPN1 (0.58) PTPN1AKR1C3AKR1C2AKR1C1CNR1
SCHEMBL9249295 0.86 PTPN1 (0.58) PTPN1AKR1C3AKR1C2AKR1C1CNR1
Zinc Ion SCHEMBL7087886 0.84 ESR1 (0.43) CNR1CNR2ESR1ESR2ALDH1A1
SCHEMBL9014936 0.83 PTPN1 (0.54) PTPN1AKR1C3AKR1C2AKR1C1CNR1
Zinc Ion SCHEMBL7089336 0.83 ESR1 (0.42) CNR1CNR2ESR1ESR2ALDH1A1
Zinc Ion SCHEMBL7088082 0.83 PTPN1 (0.42) PTPN1AKR1C3AKR1C2AKR1C1PTPN6
Water SCHEMBL9852465 0.82 ESR1 (0.41) CNR1CNR2ESR1ESR2ALDH1A1

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
US-20030191023-A1 Thermosensitive recording material FUJI PHOTO FILM CO., LTD. 2003-10-09 US disclosed
EP-0275107-B1 AN AQUEOUS DEVELOPER DISPERSION FOR A PRESSURE-SENSITIVE RECORDING SHEET AND A PROCESS FOR PRODUCING THE SAME Sanko Kaihatsu Kagaku Kenkyusho (JP) 1993-03-31 EP disclosed
US-4950330-A SUPERIOR STORAGE STABILITY AND MATERIAL HANDLING SANKO KAIHATSU KAGAKU KENKYUSHO (JP) 1990-08-21 US disclosed
EP-0275107-A2 An aqueous developer dispersion for a pressure-sensitive recording sheet and a process for producing the same Sanko Kaihatsu Kagaku Kenkyusho (JP) 1988-07-20 EP disclosed
US-4311758-A INORGANIC PIGMENTS IN THE COLOR DEVELOPER LAYER KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1982-01-19 US disclosed