SCHEMBL18906968

SCHEMBL18906968

COc1ccc(C2COc3c4c(c(CC=C(C)C)c(O)c3C2=O)OC(C)(C)C=C4)cc1OC

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ODC1 P11926 5/20 0.70
PTPN1 P18031 4/20 0.48
PDE5A O76074 1/20 0.46
KDM4E B2RXH2 3/20 0.45
CYP3A4 P08684 3/20 0.45
HSD17B10 Q99714 2/20 0.45
MEN1 O00255 2/20 0.45
USP2 O75604 2/20 0.45
MAPT P10636 2/20 0.45
ALOX15 P16050 2/20 0.45
KMT2A Q03164 2/20 0.45
ALDH1A1 P00352 2/20 0.45
SLCO1B3 Q9NPD5 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
SLCO1B1 Q9Y6L6 1/20 0.45
HSD17B1 P14061 1/20 0.44
PTGES O14684 1/20 0.42
ALOX5 P09917 1/20 0.42
PDE4D Q08499 1/20 0.42
HDAC3 O15379 1/20 0.42

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
SCHEMBL18906966 0.93 ODC1 (0.62) ODC1PTPN1PDE5AKDM4ECYP3A4
SCHEMBL16259003 0.87 ODC1 (0.54) ODC1PTPN1PDE5AKDM4ECYP3A4
SCHEMBL16694477 0.72 ODC1 (0.77) ODC1PTPN1KDM4ECYP3A4USP2
SCHEMBL24305496 0.71 MAPT (0.60) PTPN1PDE5AMEN1MAPTKMT2A
SCHEMBL11911698 0.70 CYP3A4 (0.79) ODC1PTPN1KDM4ECYP3A4HSD17B10
SCHEMBL24305197 0.69 HSP90AA1 (0.46) ODC1PTPN1MEN1MAPTKMT2A
SCHEMBL20960789 0.69 HSD17B1 (0.61) ODC1PTPN1CYP3A4TDP1HSD17B1
Lupinifolinol SCHEMBL6668491 0.67 PTPN1 (0.50) ODC1PTPN1PDE5AKDM4ECYP3A4
Eriosemaone A SCHEMBL31753876 0.66 IDO1 (0.73) ODC1PTPN1MEN1MAPTKMT2A
SCHEMBL31441209 0.66 ODC1 (0.74) ODC1PTPN1MEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9974766-B2 Prenylated isoflavones for treatment of subjects with multidrug-resistant cancer MACAU UNIVERSITY OF SCIENCE AND TECHNOLOGY (MO) 2018-05-22 US disclosed
US-9974766-B2 Prenylated isoflavones for treatment of subjects with multidrug-resistant cancer MACAU UNIVERSITY OF SCIENCE AND TECHNOLOGY (MO) 2018-05-22 US disclosed
US-20170151212-A1 PRENYLATED ISOFLAVONES FOR TREATMENT OF SUBJECTS WITH MULTIDRUG-RESISTANT CANCER MACAU UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2017-06-01 US disclosed
US-20170151212-A1 PRENYLATED ISOFLAVONES FOR TREATMENT OF SUBJECTS WITH MULTIDRUG-RESISTANT CANCER MACAU UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2017-06-01 US 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-20170151212-A1 PRENYLATED ISOFLAVONES FOR TREATMENT OF SUBJECTS WITH MULTIDRUG-RESISTANT CANCER ABCB1, ABCC1, ABCB11 ODC1 4081/4885PTPN1 3874/4885PDE5A 3188/4885

“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.