SCHEMBL2523087

SCHEMBL2523087

COc1cc(C=C(C(=O)O)c2ccccc2)ccc1OC(C)=O

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.64
KMT2A Q03164 4/20 0.58
ALDH1A1 P00352 4/20 0.58
MEN1 O00255 3/20 0.58
POLB P06746 1/20 0.56
AKR1C2 P52895 2/20 0.56
KDM4E B2RXH2 1/20 0.56
HTT P42858 1/20 0.56
JUN P05412 1/20 0.56
NFKB1 P19838 1/20 0.56
RAB9A P51151 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
TSHR P16473 1/20 0.54
VCP P55072 1/20 0.51
GAA P10253 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
AKR1C1 Q04828 1/20 0.50

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
SCHEMBL2954274 1.00 AKR1C3 (0.64) AKR1C3KMT2AALDH1A1MEN1POLB
SCHEMBL2523084 1.00 AKR1C3 (0.64) AKR1C3KMT2AALDH1A1MEN1POLB
SCHEMBL2526753 0.95 AKR1C3 (0.64) AKR1C3KMT2AALDH1A1MEN1POLB
SCHEMBL12215328 0.95 AKR1C3 (0.64) AKR1C3KMT2AALDH1A1MEN1POLB
SCHEMBL12215323 0.92 ALDH1A1 (0.56) AKR1C3KMT2AALDH1A1MEN1AKR1C2
SCHEMBL3670551 0.91 KDM4E (0.67) AKR1C3KMT2AALDH1A1MEN1POLB
SCHEMBL3670549 0.91 KDM4E (0.67) AKR1C3KMT2AALDH1A1MEN1POLB
SCHEMBL31510188 0.86 AKR1C3 (0.66) AKR1C3KMT2AALDH1A1MEN1POLB
SCHEMBL28462838 0.86 AKR1C3 (0.63) AKR1C3AKR1C2AKR1C1
SCHEMBL28469876 0.86 AKR1C3 (0.63) AKR1C3AKR1C2AKR1C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1801087-B1 CIS-1,2-SUBSTITUTED STILBENE DERIVATIVES FOR TREATING AND/OR PREVENTING DIABETES INST RADIATION MED AMMS PLA (CN) 2012-08-29 EP disclosed
US-8039513-B2 Cis-1,2-substituted stilbene derivatives and their use in preparation of drugs for treatment and/or prevention of diabetes INSTITUTE OF RADIATION MEDICINE, ACADEMY OF MILITARY MEDICAL SCIENCES, PLA (CN) 2011-10-18 US disclosed
US-7759527-B2 Microwave induced one pot process for the preparation of arylethenes COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2010-07-20 US disclosed
US-20090161561-A1 Method and system for determining characters of channels HUAWEI TECHNOLOGIES CO., LTD 2009-06-25 US disclosed
US-20090076114-A1 Cis-1,2-substituted stilbene derivatives and their use in preparation of drugs for treatment and/or prevention of diabetes INSTITUTE OF RADIATION MEDICINE, ACADEMY OF MILITARY MEDICAL SCIENCES, PLA (CN) 2009-03-19 US disclosed
US-20080045752-A1 Microwave Induced One Pot Process For The Preparation Of Arylethenes COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2008-02-21 US disclosed
WO-2007110881-A1 A MICROWAVE INDUCED ONE POT PROCESS FOR THE PREPARATION OF ARYLETHENES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2007-10-04 WO disclosed
EP-1801087-A1 CIS-1,2-SUBSTITUTED STILBENE DERIVATES AND THE USE THEREROF FOR MANUFACTURING MEDICAMENTS FOR TREATING MEDICAMENTS FOR TREATING AND/OR PREVENTING DIABETES Institute of Radiation Medicine, Academy of Military Medical Sciences Pla (CN) 2007-06-27 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 (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-20080045752-A1 Microwave Induced One Pot Process For The Preparation Of Arylethenes TET2, HCN4, KDM4E AKR1C3 1213/4885KMT2A 36/4885ALDH1A1 908/4885
US-20090076114-A1 Cis-1,2-substituted stilbene derivatives and their use in preparation of drugs for treatment and/or prevention of diabetes SLC5A1, SLC5A2, SLC2A1 AKR1C3 441/4885KMT2A 4751/4885ALDH1A1 413/4885

“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.