SCHEMBL1597822

SCHEMBL1597822

Oc1ccc(C(CCCC(c2ccc(O)c(Cl)c2)c2ccc(O)c(Cl)c2)c2ccc(O)c(Cl)c2)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 3/20 0.47
HSD17B10 Q99714 4/20 0.45
TSHR P16473 2/20 0.45
CA2 P00918 2/20 0.43
CA1 P00915 1/20 0.42
ESR1 P03372 2/20 0.39
HSD17B1 P14061 1/20 0.36
HSD17B2 P37059 1/20 0.36
ADORA2A P29274 1/20 0.36
CYP1A2 P05177 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
ALOX15 P16050 2/20 0.35
ALOX12 P18054 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HIF1A Q16665 1/20 0.35
CYP3A4 P08684 2/20 0.35
CYP17A1 P05093 1/20 0.35
HSP90AA1 P07900 1/20 0.35
HSP90AB1 P08238 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
SCHEMBL9330133 0.93 ESR2 (0.42) ESR2HSD17B10TSHRCA2CA1
SCHEMBL30343452 0.92 ESR2 (0.50) ESR2HSD17B10TSHRCA2CA1
SCHEMBL1595522 0.92 ESR2 (0.50) ESR2HSD17B10TSHRCA2CA1
SCHEMBL5710018 0.86 CA2 (0.40) ESR2HSD17B10TSHRCA2CA1
SCHEMBL11013342 0.85 ESR2 (0.44) ESR2HSD17B10TSHRCA2CA1
SCHEMBL30343467 0.83 ESR2 (0.50) ESR2HSD17B10TSHRCA2CA1
SCHEMBL1597446 0.83 ESR2 (0.50) ESR2HSD17B10TSHRCA2CA1
SCHEMBL10615451 0.82 CA2 (0.50) ESR2HSD17B10TSHRCA2CA1
SCHEMBL5189783 0.80 HSD17B10 (0.42) ESR2HSD17B10TSHRCA2CA1
SCHEMBL3917934 0.80 ESR2 (0.41) ESR2HSD17B10TSHRCA2CA1

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103648275-B Shaped-tablet slime remover 日本曹达株式会社 2017-02-15 CN disclosed
EP-1780224-B1 MULTIBRANCHED POLYMERS AND PROCESS FOR PRODUCTION THEREOF NIPPON SODA CO (JP) 2015-02-18 EP disclosed
US-8710165-B2 Multibranched polymer and method for producing the same NIPPON SODA CO., LTD. (JP) 2014-04-29 US disclosed
CN-103648275-A Shaped-tablet slime remover NIPPON SODA CO 2014-03-19 CN disclosed
EP-1342706-B1 METHOD FOR PRODUCING MOLECULAR COMPOUND NIPPON SODA CO (JP) 2013-04-24 EP disclosed
EP-1676478-B1 Slime remover and slime preventing/removing agent NIPPON SODA CO (JP) 2011-08-24 EP disclosed
US-20110152388-A1 Multibranched polymer and method for producing the same NIPPON SODA CO., LTD. (JP) 2011-06-23 US disclosed
US-7919570-B2 narrowly dispersed; controlled molecular weight; ionic conductivity, shape stability; battery adhesive or binder; 1,1,2,2-tetrakis(4-hydroxyphenyl)ethane or pentaerythritol reacted with bromoisobutyroyl bromide for core; living radical polymerization of acrylate or a styrene at halogen atoms as the arms NIPPON SODA CO., LTD. (JP) 2011-04-05 US disclosed
US-7655820-B2 Comprises mixing, kneading a solid host compound and a solid/liquid guest compound by using a kneader and optionally followed by extruding and granulating, holding the product at a temperature above 50; product has improved stability NIPPON SODA CO., LTD. (JP) 2010-02-02 US disclosed
US-7601784-B2 1,1,2,2-tetrakis(4-hydroxyphenyl)ethane is used to molecular alignment, chemical stabilization, heat resist, flexiable and modification of the polyether having hydrogen bond sites; for waste water treatments, energy transducers, conductors NIPPON SODA CO., LTD. (JP) 2009-10-13 US disclosed
US-20040030123-A1 Method for producing molecular compound NIPPON SODA CO., LTD. (JP) 2004-02-12 US disclosed
EP-1342706-A1 METHOD FOR PRODUCING MOLECULAR COMPOUND NIPPON SODA CO., LTD. (JP) 2003-09-10 EP disclosed
US-6528467-B1 Clathrates such as 5-chloro-2-methyl-4-isothiazolin-3-one and pressure molded 1,1-bis(4-hydroxyphenyl)cyclohexane host compounds, used for unclogging drains NIPPON SODA CO., LTD. (JP) 2003-03-04 US disclosed
US-20030032569-A1 Slime remover and slime preventing/removing agent NIPPON SODA CO., LTD. 2003-02-13 US disclosed
US-20020193528-A1 Molecular compound comprising polymer having hydrogen bond as component compound NIPPON SODA CO., LTD. (JP) 2002-12-19 US disclosed
EP-1241230-A1 MOLECULAR COMPOUND COMPRISING POLYMER HAVING HYDROGEN BOND AS COMPONENT COMPOUND NIPPON SODA CO., LTD. (JP) 2002-09-18 EP disclosed
EP-1113112-A1 SLIME REMOVER AND SLIME PREVENTING/REMOVING AGENT NIPPON SODA CO., LTD. (JP) 2001-07-04 EP disclosed
EP-0589044-B1 NOVEL INCLUSION COMPOUND COMPRISING TETRAKISPHENOL AS HOST NIPPON SODA CO (JP) 1996-10-23 EP disclosed
US-5364977-A Chemical stabilization and powder processing NIPPON SODA CO., LTD. (JP) 1994-11-15 US disclosed
EP-0589044-A1 NOVEL INCLUSION COMPOUND COMPRISING TETRAKISPHENOL AS HOST NIPPON SODA CO., LTD. (JP) 1994-03-30 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020193528-A1 Molecular compound comprising polymer having hydrogen bond as component compound PIEZO1, PARN, PARG ESR2 1617/4885HSD17B10 3191/4885TSHR 3605/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.