SCHEMBL6846496

SCHEMBL6846496

O=C(O)c1cc(O)c(O)c(O)c1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 4/20 0.52
HNF4A P41235 3/20 0.52
THRB P10828 1/20 0.52
DHFR P00374 1/20 0.52
MCL1 Q07820 1/20 0.52
AKR1C2 P52895 4/20 0.51
AKR1C1 Q04828 4/20 0.51
PTPN1 P18031 3/20 0.49
AKR1C3 P42330 2/20 0.47
AKR1C4 P17516 1/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 2/20 0.47
KDM4E B2RXH2 1/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
HMGB1 P09429 1/20 0.47
CA4 P22748 1/20 0.47
CA6 P23280 1/20 0.47
CA7 P43166 1/20 0.47

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
SCHEMBL31237054 0.84 ACMSD (0.50) ACMSDHNF4ATHRBDHFRMCL1
SCHEMBL674849 0.83 SELL (0.50) THRBAKR1C2AKR1C1AKR1C3AKR1C4
SCHEMBL31674337 0.83 SELL (0.50) THRBAKR1C2AKR1C1AKR1C3AKR1C4
SCHEMBL29493314 0.83 SELL (0.50) THRBAKR1C2AKR1C1AKR1C3AKR1C4
SCHEMBL27592786 0.81 AKR1C2 (0.39) ACMSDHNF4ATHRBDHFRMCL1
SCHEMBL15668658 0.80 AKR1C2 (0.44) ACMSDHNF4ATHRBDHFRMCL1
SCHEMBL27610790 0.80 GPR35 (0.53) ALDH1A1HPGDKDM4EGPR35HSD17B10
SCHEMBL27610806 0.80 AKR1C2 (0.41) ACMSDHNF4ATHRBDHFRMCL1
SCHEMBL4735008 0.80 SMN1; SMN2 (0.54) AKR1C2AKR1C3ALDH1A1HPGDKDM4E
SCHEMBL5712223 0.79 ACMSD (0.50) ACMSDHNF4ATHRBDHFRMCL1

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-3636600-B1 A SORPTION COMPOSITION FOR COMPLEX WATER PURIFICATION EWI BVBA (BE) 2022-11-30 EP disclosed
US-6716565-B2 APPLICABLE TO IMAGE-FORMING MATERIALS SUCH AS THREE-DIMENSIONAL MODELLING BY LIGHT, HOLOGRAPHY, LITHOGRAPHIC PRINTING PLATES, COLOR PROOFS, PHOTORESISTS AND COLOR FILTERS, AND INKS, PAINTS AND ADHESIVES FUJI PHOTO FILM CO., LTD. (JP) 2004-04-06 US disclosed
US-20030057610-A1 Applicable to image-forming materials such as three-dimensional modelling by light, holography, lithographic printing plates, color proofs, photoresists and color filters, and inks, paints and adhesives FUJIFILM CORPORATION (JP) 2003-03-27 US disclosed
EP-1223467-A2 Positive image-forming material FUJI PHOTO FILM CO., LTD. (JP) 2002-07-17 EP disclosed