Nyasol

Nyasol

SCHEMBL799383

C=C[C@H](/C=C\c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 5/20 0.43
ESR1 P03372 4/20 0.42
ESR2 Q92731 3/20 0.42
MAOB P27338 3/20 0.41
AKR1B1 P15121 3/20 0.41
PTGS2 P35354 2/20 0.41
AKR1B10 O60218 2/20 0.41
GLO1 Q04760 1/20 0.41
CAMK2A Q9UQM7 1/20 0.41
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 3/20 0.41
MAPT P10636 3/20 0.41
CYP2C9 P11712 3/20 0.41
CA12 O43570 3/20 0.41
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA3 P07451 3/20 0.41
CA4 P22748 3/20 0.41
CA6 P23280 3/20 0.41
CA5A P35218 3/20 0.41

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
Nyasol SCHEMBL8416158 1.00 APP (0.43) APPESR1ESR2MAOBAKR1B1
Nyasol SCHEMBL776219 1.00 APP (0.43) APPESR1ESR2MAOBAKR1B1
Nyasol SCHEMBL776218 1.00 APP (0.43) APPESR1ESR2MAOBAKR1B1
Nyasol SCHEMBL30712027 1.00 APP (0.43) APPESR1ESR2MAOBAKR1B1
SCHEMBL13558420 0.92 CYP3A4 (0.46) APPESR1ESR2MAOBAKR1B1
SCHEMBL7861271 0.92 CYP3A4 (0.46) APPESR1ESR2MAOBAKR1B1
SCHEMBL799612 0.90 MAOB (0.39) APPESR1ESR2MAOBAKR1B1
SCHEMBL805124 0.87 MAPT (0.50) ESR2PTGS2KDM4EALDH1A1MAPT
SCHEMBL7861615 0.87 MAPT (0.50) ESR2PTGS2KDM4EALDH1A1MAPT
SCHEMBL7864584 0.87 MAPT (0.50) ESR2PTGS2KDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8431166-B2 Composition comprising the extract of Anemarrhena asphodeloides Bunge or the compounds isolated from the same for preventing and treating lipid metabolism disorder EWHA UNIVERSITY-INDUSTRY COLLABORATION FOUNDATION (KR) 2013-04-30 US disclosed
US-8431166-B2 Composition comprising the extract of Anemarrhena asphodeloides Bunge or the compounds isolated from the same for preventing and treating lipid metabolism disorder EWHA UNIVERSITY-INDUSTRY COLLABORATION FOUNDATION (KR) 2013-04-30 US disclosed
US-20120070515-A1 Composition Comprising the Extract of Anemarrhena Asphodeloides Bunge or the Compounds Isolated from the Same for Preventing and Treating Lipid Metabolism Disorder EWHA UNIVERSITY- INDUSTRY COLLABORATION FOUNDATION (KR) 2012-03-22 US disclosed
US-20120070515-A1 Composition Comprising the Extract of Anemarrhena Asphodeloides Bunge or the Compounds Isolated from the Same for Preventing and Treating Lipid Metabolism Disorder EWHA UNIVERSITY- INDUSTRY COLLABORATION FOUNDATION (KR) 2012-03-22 US disclosed
WO-2010120029-A1 COMPOSITION COMPRISING THE EXTRACT OF ANEMARRHENA ASPHODELOIDES BUNGE OR THE COMPOUNDS ISOLATED FROM THE SAME FOR PREVENTING AND TREATING LIPID METABOLISM DISORDER EWHA UNIVERSITY - INDUSTRY COLLABORATION FOUNDATION (KR) 2010-10-21 WO 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-20120070515-A1 Composition Comprising the Extract of Anemarrhena Asphodeloides Bunge or the Compounds Isolated from the Same for Preventing and Treating Lipid Metabolism Disorder FABP4, ACACB, LIPC APP 698/4885ESR1 2003/4885ESR2 943/4885

“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.