SCHEMBL1001138

SCHEMBL1001138

CC(c1ccccc1)(c1ccccc1)c1ccc(O)c(O)c1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.52
ESR2 Q92731 3/20 0.52
ALDH1A1 P00352 5/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
ALOX15 P16050 2/20 0.38
CYP2C19 P33261 2/20 0.37
HIF1A Q16665 2/20 0.37
HPGD P15428 2/20 0.37
HSD17B10 Q99714 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
MAPK1 P28482 1/20 0.35
CA2 P00918 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL23861352 0.96 ESR1 (0.52) ESR1ESR2ALDH1A1CYP3A4TSHR
SCHEMBL21340183 0.80 ESR1 (0.50) ESR1ESR2ALDH1A1CYP3A4TSHR
SCHEMBL23861353 0.79 HPGD (0.39) ESR1ESR2ALDH1A1CYP3A4TSHR
SCHEMBL7160137 0.78 CYP2D6 (0.55) ESR1ESR2ALDH1A1CYP3A4TDP1
SCHEMBL983097 0.77 ALDH1A1 (0.60) ESR1ESR2ALDH1A1CYP3A4TSHR
SCHEMBL9846448 0.76 ESR1 (0.57) ESR1ESR2ALDH1A1CYP3A4TSHR
SCHEMBL2788791 0.75 ESR1 (0.55) ESR1ESR2ALDH1A1CYP3A4TSHR
SCHEMBL8987443 0.74 ESR1 (0.50) ESR1ESR2ALDH1A1CYP3A4TSHR
SCHEMBL9815465 0.74 ALDH1A1 (0.59) ESR1ESR2ALDH1A1CYP3A4TSHR
SCHEMBL25710685 0.74 IDO1 (0.50) ESR1ESR2ALDH1A1CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3331959-B1 ANIONIC CURABLE COMPOSITIONS DESIGNER MOLECULES INC (US) 2022-10-05 EP claimed
US-20220204696-A1 PHENOLIC FUNCTIONALIZED POLYIMIDES AND COMPOSITIONS THEREOF DESIGNER MOLECULES, INC 2022-06-30 US claimed
WO-2020219852-A1 PHENOLIC FUNCTIONALIZED POLYIMIDES AND COMPOSITIONS THEREOF DESIGNER MOLECULES, INC. (US) 2020-10-29 WO claimed
US-20180237668-A1 ANIONIC CURABLE COMPOSITIONS DESIGNER MOLECULES, INC. 2018-08-23 US claimed
EP-3331959-A1 ANIONIC CURABLE COMPOSITIONS Designer Molecules, Inc. (US) 2018-06-13 EP claimed
WO-2017027482-A1 ANIONIC CURABLE COMPOSITIONS DESIGNER MOLECULES, INC. (US) 2017-02-16 WO claimed
US-20130299747-A1 CURATIVES FOR EPOXY COMPOSITIONSERS DESIGNER MOLECULES, INC. 2013-11-14 US claimed
US-20130199724-A1 CURATIVES FOR EPOXY COMPOSITIONS DESIGNER MOLECULES, INC. (US) 2013-08-08 US claimed
US-8431655-B2 Curatives for epoxy compositions DESIGNER MOLECULES, INC. (US) 2013-04-30 US claimed
US-8344076-B2 Prepared by the reaction of an epoxy compound and a reactive ester; adhesive DESIGNER MOLECULES, INC. (US) 2013-01-01 US claimed
US-7825188-B2 Thermoplastic elastomer with acyloxyphenyl hard block segment DESIGNER MOLECULES, INC. (US) 2010-11-02 US claimed
US-20100249276-A1 CURATIVES FOR EPOXY COMPOSITIONS DESIGNER MOLECULES, INC. (US) 2010-09-30 US claimed
WO-2008124797-A1 CURATIVES FOR EPOXY COMPOSITIONS DESIGNER MOLECULES, INC. (US) 2008-10-16 WO claimed
WO-2008077140-A2 HYDROLYTICALLY RESISTANT THERMOSET MONOMERS DESIGNER MOLECULES, INC. (US) 2008-06-26 WO claimed
WO-2008077141-A1 RUBBER EPOXY CURATIVES AND METHODS FOR USE THEREOF DESIGNER MOLECULES, INC. (US) 2008-06-26 WO claimed
US-20080142158-A1 HYDROLYTICALLY RESISTANT THERMOSET MONOMERS DESIGNER MOLECULES, INC. 2008-06-19 US claimed
US-20080146738-A1 RUBBER EPOXY CURATIVES AND METHODS FOR USE THEREOF DESIGNER MOLECULES, INC. 2008-06-19 US claimed
US-20080017308-A1 Derivatives of poly(styrene-co-allyl alcohol) and methods for use thereof DESIGNER MOLECULES, INC. 2008-01-24 US claimed
US-20070299154-A1 Mold compositions with high adhesion to metal substrates DESIGNER MOLECULES, INC. 2007-12-27 US claimed
US-6211389-B1 TREATING SPECIFICALLY DEFINED COMBINATIONS COMPRISING AN EPOXY RESIN STARTING MATERIAL AND OTHER COMPONENTS TO ORGANIC SOLVENT, A CROWN ETHER, AND A SUITABLE BASE TO CONDITIONS SUFFICIENT TO PRODUCE A TREATED EPOXY COMPOUND DEXTER CORPORATION 2001-04-03 US claimed

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

For each of this compound's patents that has machine-readable text (2 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-20080142158-A1 HYDROLYTICALLY RESISTANT THERMOSET MONOMERS ESD, JMJD7, PCNA ESR1 138/4885ESR2 1386/4885ALDH1A1 519/4885
US-20100249276-A1 CURATIVES FOR EPOXY COMPOSITIONS ALOX5, LTC4S, ALOX15B ESR1 322/4885ESR2 1074/4885ALDH1A1 211/4885

“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.