SCHEMBL9252935

SCHEMBL9252935

CC(C)(c1ccccc1)c1cc(Oc2cc(C(C)(C)c3ccccc3)cc(C(C)(C)c3ccccc3)c2O)c(O)c(C(=O)O)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
ESR1 P03372 3/20 0.38
ESR2 Q92731 2/20 0.38
CYP3A4 P08684 1/20 0.38
HTT P42858 2/20 0.36
CNR1 P21554 2/20 0.36
CNR2 P34972 2/20 0.36
HPGD P15428 5/20 0.35
HSD17B10 Q99714 5/20 0.35
KDM4E B2RXH2 4/20 0.35
TSHR P16473 2/20 0.35
CYP2C9 P11712 2/20 0.35
THRB P10828 1/20 0.35
ALOX12 P18054 1/20 0.35
ATIC P31939 1/20 0.35
ITGB3 P05106 1/20 0.35
ITGA2B P08514 1/20 0.35
HMGB1 P09429 1/20 0.35
GGT1 P19440 1/20 0.35
PTGS1 P23219 1/20 0.35

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
SCHEMBL9250668 0.93 ALDH1A1 (0.43) ALDH1A1ESR1ESR2CYP3A4HTT
SCHEMBL1129729 0.87 ESR1 (0.46) ALDH1A1ESR1ESR2CYP3A4HTT
SCHEMBL7084776 0.86 ESR1 (0.44) ALDH1A1ESR1ESR2CYP3A4HTT
Water SCHEMBL9852464 0.86 ESR1 (0.44) ALDH1A1ESR1ESR2CYP3A4HTT
Water SCHEMBL9852463 0.85 ESR1 (0.43) ALDH1A1ESR1ESR2CYP3A4HTT
SCHEMBL9615388 0.80 NR5A2 (0.45) ALDH1A1ESR1ESR2CYP3A4HTT
SCHEMBL9615386 0.80 NR5A2 (0.48) ALDH1A1ESR1ESR2CYP3A4HTT
SCHEMBL11755343 0.79 GLRA3 (0.45) ALDH1A1CYP3A4TSHRCYP2C9PTGS2
SCHEMBL11753846 0.77 CNR1 (0.50) ALDH1A1ESR1ESR2CYP3A4HTT
SCHEMBL1129446 0.77 ALDH1A1 (0.49) ALDH1A1ESR1ESR2CYP3A4CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0338808-B1 Alkyl salicylate resin for carbonless copy paper and imaging use SCHENECTADY INT INC (US) 1995-08-23 EP disclosed
US-5017546-A Metallized phenolic resins SCHENECTADY INTERNATIONAL, INC. 1991-05-21 US disclosed
US-4999333-A For facsimile and thermal printing FUJI PHOTO FILM CO., LTD. (JP) 1991-03-12 US disclosed
EP-0338808-A2 Alkyl salicylate resin for carbonless copy paper and imaging use SCHENECTADY INTERNATIONAL, INC. (US) 1989-10-25 EP disclosed
US-4134847-A HOMOGENIZING AN AROMATIC CARBOXYLIC ACID-POLYMER-METAL CARBONATE OR OXIDE MELT KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1979-01-16 US disclosed
US-4046941-A PRESSURE SENSITIVE COPYING SANKO CHEMICAL COMPANY LTD. (JA) 1977-09-06 US disclosed