SCHEMBL19086304

SCHEMBL19086304

COc1ccc(/C=C/C(=O)c2cc(OC)c(OC)cc2O)cc1OC

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 6/20 0.78
CYP3A4 P08684 3/20 0.78
MEN1 O00255 3/20 0.78
KMT2A Q03164 3/20 0.78
MAPT P10636 2/20 0.78
SMN1; SMN2 Q16637 2/20 0.78
TDP1 Q9NUW8 2/20 0.78
ALDH1A1 P00352 1/20 0.78
TP53 P04637 1/20 0.78
HPGD P15428 1/20 0.78
ALOX15 P16050 1/20 0.78
ALOX12 P18054 1/20 0.78
MAPK1 P28482 1/20 0.78
FLT3 P36888 1/20 0.76
ACHE P22303 1/20 0.75
MAOB P27338 1/20 0.75
AR P10275 2/20 0.74
CYP1A2 P05177 1/20 0.71
CYP2D6 P10635 1/20 0.71
CYP2C9 P11712 1/20 0.71

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
SCHEMBL19086305 1.00 ABCG2 (0.78) ABCG2CYP3A4MEN1KMT2AMAPT
SCHEMBL28678909 0.90 MAOB (0.71) ABCG2CYP3A4MEN1KMT2AMAPT
SCHEMBL29416645 0.90 MAOB (0.71) ABCG2CYP3A4MEN1KMT2AMAPT
SCHEMBL30383806 0.87 ABCG2 (1.00) ABCG2CYP3A4MEN1KMT2AMAPT
SCHEMBL633469 0.87 ABCG2 (1.00) ABCG2CYP3A4MEN1KMT2AMAPT
SCHEMBL25217986 0.87 ABCG2 (1.00) ABCG2CYP3A4MEN1KMT2AMAPT
SCHEMBL25223496 0.87 CYP3A4 (0.67) ABCG2CYP3A4MEN1KMT2AMAPT
SCHEMBL633470 0.87 ABCG2 (1.00) ABCG2CYP3A4MEN1KMT2AMAPT
SCHEMBL25223485 0.87 CYP3A4 (0.66) ABCG2CYP3A4MEN1KMT2AMAPT
SCHEMBL25238512 0.87 ACHE (0.81) ABCG2CYP3A4MEN1KMT2AMAPT

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-3188721-B1 HUMAN THERAPEUTIC AGENTS ANKH LIFE SCIENCES LTD (IE) 2019-06-12 EP claimed
US-20170216222-A1 THERAPEUTIC COMPOSITIONS CONTAINING HARMINE AND ISOVANILLIN COMPONENTS, AND METHODS OF USE THEREOF IONS PHARMACEUTICAL S.À R.L. (LU) 2017-08-03 US claimed
EP-3188721-A1 HUMAN THERAPEUTIC AGENTS Ions Pharmaceutical S.À.R.L. (LU) 2017-07-12 EP claimed
WO-2023090908-A1 NOVEL FLAVONOID DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT FOR PREVENTION OR TREATMENT OF METABOLIC DISEASE 고려대학교 세종산학협력단 2023-05-25 WO disclosed
EP-3275465-B1 THERAPEUTIC COMPOSITIONS COMPRISING A COMBINATION OF A HARMINE AND ISOVANILLIN COMPONENT ANKH LIFE SCIENCES LTD (IE) 2020-05-06 EP disclosed
EP-3188721-B1 HUMAN THERAPEUTIC AGENTS ANKH LIFE SCIENCES LTD (IE) 2019-06-12 EP disclosed
EP-3275465-A1 THERAPEUTIC COMPOSITIONS COMPRISING A COMBINATION OF A HARMINE AND ISOVANILLIN COMPONENT Ions Pharmaceutical S.À.R.L. (LU) 2018-01-31 EP disclosed
WO-2017132135-A1 ESTROGEN RECEPTOR ALPHA COLIGANDS, AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-08-03 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-20170216222-A1 THERAPEUTIC COMPOSITIONS CONTAINING HARMINE AND ISOVANILLIN COMPONENTS, AND METHODS OF USE THEREOF INMT, HNMT, COMT ABCG2 629/4885CYP3A4 1368/4885MEN1 2595/4885

“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.