SCHEMBL17145017

SCHEMBL17145017

COc1ccc(-c2cccc(-c3ccc(OC)c(OC)c3)n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.56
ALDH1A1 P00352 5/20 0.56
NPC1 O15118 4/20 0.56
RAB9A P51151 4/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
HPGD P15428 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
HSD17B10 Q99714 2/20 0.56
HTT P42858 2/20 0.56
USP2 O75604 1/20 0.56
TSHR P16473 1/20 0.56
MAPK1 P28482 1/20 0.56
ATM Q13315 1/20 0.56
FYN P06241 1/20 0.56
ALDH1A3 P47895 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.55
MAPT P10636 4/20 0.52
FPR2 P25090 1/20 0.52
LMNA P02545 1/20 0.51

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
SCHEMBL17144996 0.91 KDM4E (0.65) KDM4EALDH1A1NPC1RAB9AMEN1
SCHEMBL17144809 0.86 CYP1A1 (0.54) KDM4EALDH1A1NPC1RAB9AMEN1
SCHEMBL3628069 0.86 NPC1 (0.61) KDM4EALDH1A1NPC1RAB9AMEN1
SCHEMBL17144923 0.85 PDGFRB (0.59) KDM4EALDH1A1NPC1RAB9AMEN1
SCHEMBL17145111 0.85 ALDH1A1 (0.61) KDM4EALDH1A1NPC1RAB9AMEN1
SCHEMBL5950603 0.84 NPC1 (0.59) KDM4EALDH1A1NPC1RAB9AMEN1
SCHEMBL18492964 0.83 HDAC8 (0.58) KDM4EALDH1A1NPC1RAB9AMEN1
SCHEMBL13680448 0.81 KDM4E (0.58) KDM4EALDH1A1NPC1RAB9AMEN1
SCHEMBL17144798 0.81 CYP1A1 (0.61) KDM4EALDH1A1NPC1RAB9AMEN1
SCHEMBL29992900 0.80 RAB9A (0.64) KDM4EALDH1A1NPC1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10017475-B2 Anti-vasculature and anti-tubulin combretastatin analogs for treatment of cancer XAVIER UNIVERSITY OF LOUSIANA (US) 2018-07-10 US claimed
US-20170044103-A1 ANTI-VASCULATURE AND ANTI-TUBULIN COMBRETASTATIN ANALOGS FOR TREATMENT OF CANCER XAVIER UNIVERSITY OF LOUISIANA 2017-02-16 US claimed
WO-2015153252-A1 ANTI-VASCULATURE AND ANTI-TUBULIN COMBRETASTATIN ANALOGS FOR TREATMENT OF CANCER XAVIER UNIVERSITY OF LOUISIANA (US) 2015-10-08 WO claimed
US-10017475-B2 Anti-vasculature and anti-tubulin combretastatin analogs for treatment of cancer XAVIER UNIVERSITY OF LOUSIANA (US) 2018-07-10 US disclosed
US-20170044103-A1 ANTI-VASCULATURE AND ANTI-TUBULIN COMBRETASTATIN ANALOGS FOR TREATMENT OF CANCER XAVIER UNIVERSITY OF LOUISIANA 2017-02-16 US disclosed
US-20170044103-A1 ANTI-VASCULATURE AND ANTI-TUBULIN COMBRETASTATIN ANALOGS FOR TREATMENT OF CANCER XAVIER UNIVERSITY OF LOUISIANA 2017-02-16 US disclosed
WO-2015153252-A1 ANTI-VASCULATURE AND ANTI-TUBULIN COMBRETASTATIN ANALOGS FOR TREATMENT OF CANCER XAVIER UNIVERSITY OF LOUISIANA (US) 2015-10-08 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 (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-20170044103-A1 ANTI-VASCULATURE AND ANTI-TUBULIN COMBRETASTATIN ANALOGS FOR TREATMENT OF CANCER FLT4, TUBB3, TUBA4A KDM4E 3658/4885ALDH1A1 3306/4885NPC1 2308/4885
US-10017475-B2 Anti-vasculature and anti-tubulin combretastatin analogs for treatment of cancer FLT4, TUBB3, TUBA4A KDM4E 3658/4885ALDH1A1 3306/4885NPC1 2308/4885

“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.