SCHEMBL720618

SCHEMBL720618

OC[C@]1(O)C(c2ccccc2)[C@]2(O)C(O)C(c3ccccc3)[C@@]21O

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 5/20 0.37
KDM1A O60341 1/20 0.34
HTR2A P28223 2/20 0.32
HTR2C P28335 2/20 0.32
HTR2B P41595 2/20 0.32
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL10706515 1.00 ABCB1 (0.37) ABCB1KDM1AHTR2AHTR2CHTR2B
SCHEMBL5931140 0.93 ABCB1 (0.35) ABCB1KDM1AALDH1A1
SCHEMBL5931088 0.93 ABCB1 (0.35) ABCB1KDM1AALDH1A1
SCHEMBL5931152 0.91 ABCB1 (0.35) ABCB1ALDH1A1
SCHEMBL5931132 0.91 ABCB1 (0.35) ABCB1ALDH1A1
SCHEMBL5931268 0.89 ABCB1 (0.34) ABCB1KDM1AALDH1A1
SCHEMBL5931172 0.89 ABCB1 (0.34) ABCB1KDM1AALDH1A1
SCHEMBL9679091 0.87 ABCB1 (0.37) ABCB1KDM1AHTR2AHTR2CHTR2B
SCHEMBL5931161 0.85 PTGS2 (0.33)
SCHEMBL5931156 0.85 ABCB1 (0.33) ABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1765843-B1 PROCESS FOR PREPARING A PULVERULENT ALDITOL ACETAL COMPOSITION BASF SE (DE) 2016-05-18 EP claimed
US-20120048146-A1 PROCESS FOR PREPARING A PULVERULENT ALDITOL ACETAL COMPOSITION WYART HERVE (FR) 2012-03-01 US claimed
US-20070246685-A1 Process for Preparing a Pulverulent Alditol Acetal Composition CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2007-10-25 US claimed
EP-1042263-B1 ALDITOL ACETAL COMPOSITION AND ITS USE IN PLASTIC AND GELLED MATERIALS ROQUETTE FRERES (FR) 2004-03-17 EP claimed
US-6673856-B1 1,3-2,4-DI(BENZYLIDENE) SORBITOL (DBS) OR ONE OF ITS ALKYLATED DERIVATIVES, FREE FLOWING, THERMAL STABILITY ROQUETTE FRERES (FR) 2004-01-06 US claimed
EP-0581024-B1 Polyester compounds and organic gelling agents comprising same NEW JAPAN CHEM CO LTD (JP) 1997-04-02 EP claimed
US-5356566-A Polyester compounds and organic gelling agents comprising same NEW JAPAN CHEMICAL CO., LTD. (JP) 1994-10-18 US claimed
EP-0581024-A1 Polyester compounds and organic gelling agents comprising same NEW JAPAN CHEMICAL CO.,LTD. (JP) 1994-02-02 EP claimed
US-4429140-A IN HYDROPHOBIC AND WATER SOLUBLE SOLVENTS NEW JAPAN CHEMICAL CO., LTD. (JP) 1984-01-31 US claimed
JP-63304079-A None JP disclosed
JP-6073170-A None JP disclosed
JP-10087999-A None JP disclosed
JP-11060960-A None JP disclosed
JP-5186664-A None JP disclosed
US-5356566-A Polyester compounds and organic gelling agents comprising same NEW JAPAN CHEMICAL CO., LTD. (JP) 1994-10-18 US disclosed
JP-H0673170-A POLYESTER COMPOUND AND ORGANIC GELLING AGENT CONTAINING THE SAME NEW JAPAN CHEM CO LTD 1994-03-15 JP disclosed
EP-0581024-A1 Polyester compounds and organic gelling agents comprising same NEW JAPAN CHEMICAL CO.,LTD. (JP) 1994-02-02 EP disclosed
US-5238783-A PHOTOSENSITIVE POLYMER COMPOSITION FOR WATER DEVELOPABLE FLEXOGRAPHIC PRINTING PLATE TORAY INDUSTRIES, INC. (JP) 1993-08-24 US disclosed
JP-H05186664-A MOLDING MATERIAL OF THERMOSETTING RESIN SUMITOMO BAKELITE CO LTD 1993-07-27 JP disclosed
JP-S63304079-A NON-AQUEOUS GELLING AGENT AND GELLED COSMETIC CONTAINING SAME KAO CORP 1988-12-12 JP 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-20070246685-A1 Process for Preparing a Pulverulent Alditol Acetal Composition ALDOA, SORD, DCXR ABCB1 4656/4885KDM1A 4167/4885HTR2A 4856/4885

“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.