SCHEMBL10028313

SCHEMBL10028313

COc1cc2c(cc1OC)CN(Cc1cccc(C(=O)O)c1)CC2

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.62
TDP1 Q9NUW8 1/20 0.62
REV1 Q9UBZ9 1/20 0.59
GAA P10253 1/20 0.59
MAPT P10636 1/20 0.59
RAB9A P51151 1/20 0.59
ABCB1 P08183 9/20 0.59
AKR1C3 P42330 1/20 0.58
KMT2A Q03164 2/20 0.58
ABCC1 P33527 3/20 0.58
ABCG2 Q9UNQ0 3/20 0.58
NPC1 O15118 1/20 0.55
ACHE P22303 1/20 0.54
ALDH1A1 P00352 1/20 0.54
LMNA P02545 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
HIF1A Q16665 1/20 0.54

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
SCHEMBL3059182 0.84 KDM4E (0.64) KDM4ETDP1GAAMAPTRAB9A
SCHEMBL3054653 0.84 KDM4E (0.62) KDM4ETDP1MAPTABCB1ALDH1A1
SCHEMBL5131462 0.83 KDM4E (0.71) KDM4ETDP1REV1GAAMAPT
SCHEMBL16061513 0.83 L3MBTL1 (0.63) KDM4EAKR1C3KMT2AALDH1A1CYP2D6
SCHEMBL5129280 0.82 REV1 (0.66) KDM4ETDP1REV1GAAMAPT
SCHEMBL3050446 0.81 KDM4E (0.51) KDM4ETDP1REV1GAAMAPT
SCHEMBL3052643 0.80 KDM4E (0.53) KDM4ETDP1REV1GAAMAPT
SCHEMBL5130886 0.80 REV1 (0.67) KDM4ETDP1REV1GAAMAPT
SCHEMBL3049297 0.80 KDM4E (0.52) KDM4ETDP1GAAMAPTRAB9A
SCHEMBL5128393 0.79 REV1 (0.69) KDM4ETDP1REV1GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180125811-A1 9,10-Alpha,Alpha-OH-Taxane Analogs and Methods for Production Thereof TAPESTRY PHARMACEUTICALS, INC. 2018-05-10 US disclosed
US-9820962-B2 9, 10-α, α-oh-taxane analogs and methods for production thereof TAPESTRY PHARMACEUTICALS, INC. (US) 2017-11-21 US disclosed
US-9820962-B2 9, 10-α, α-oh-taxane analogs and methods for production thereof TAPESTRY PHARMACEUTICALS, INC. (US) 2017-11-21 US disclosed
US-20160331718-A1 9, 10-ALPHA, ALPHA-OH-TAXANE ANALOGS AND METHOD FOR PRODUCTION THEREOF TAPESTRY PHARMACEUTICALS, INC. 2016-11-17 US disclosed
US-20160331718-A1 9, 10-ALPHA, ALPHA-OH-TAXANE ANALOGS AND METHOD FOR PRODUCTION THEREOF TAPESTRY PHARMACEUTICALS, INC. 2016-11-17 US disclosed
US-9402824-B2 9,10-α, α-OH-taxane analogs and methods for production thereof TAPESTRY PHARMACEUTICALS, INC. (US) 2016-08-02 US disclosed
US-9402824-B2 9,10-α, α-OH-taxane analogs and methods for production thereof TAPESTRY PHARMACEUTICALS, INC. (US) 2016-08-02 US disclosed
US-20150133536-A1 9, 10-Alpha, Alpha-OH-Taxane Analogs and Methods for Production Thereof TAPESTRY PHARMACEUTICALS, INC. (US) 2015-05-14 US disclosed
US-20150133536-A1 9, 10-Alpha, Alpha-OH-Taxane Analogs and Methods for Production Thereof TAPESTRY PHARMACEUTICALS, INC. (US) 2015-05-14 US disclosed
US-8962870-B2 9, 10-α, α-OH-taxane analogs and methods for production thereof TAPESTRY PHARMACEUTICALS, INC. (US) 2015-02-24 US disclosed
US-8962870-B2 9, 10-α, α-OH-taxane analogs and methods for production thereof TAPESTRY PHARMACEUTICALS, INC. (US) 2015-02-24 US disclosed
US-20120077871-A1 9, 10-Alpha, Alpha-OH-Taxane Analogs and Methods for Production Thereof TAPESTRY PHARMACEUTICALS, INC. (US) 2012-03-29 US disclosed
US-7879904-B2 9, 10-α,α-OH-taxane analogs and methods for production thereof TAPESTRY PHARMACEUTICALS, INC. (US) 2011-02-01 US disclosed
US-20100324128-A1 9, 10-Alpha, Alpha-OH-Taxane Analogs and Methods for Production Thereof TAPESTRY PHARMACEUTICALS, INC. (US) 2010-12-23 US disclosed
US-7745650-B2 alpha stereochemistry at the C-9 and C-10 OH positions offers excellent inhibition of cell growth against MDR sensitive cancer cell lines; starting materials are Paclitaxel and Docetaxel; increased biological activity; side effect reduction; solubility; better therapeutic profile; anticancer TAPESTRY PHARMACEUTICALS, INC (US) 2010-06-29 US disclosed
EP-1664033-B1 9,10-ALPHA,ALPHA-OH-TAXANE ANALOGS AND METHODS FOR PRODUCTION THE REOF TAPESTRY PHARMACEUTICALS INC (US) 2007-11-07 EP disclosed
EP-1810968-A2 9, 10-a, a-OH-texane analogs and methods for production thereof Tapestry Pharmaceuticals, Inc. (US) 2007-07-25 EP disclosed
EP-1785416-A2 9, 10-alpha, alpha-OH-Taxane Analogs and methods for production thereof Tapestry Pharmaceuticals, Inc. (US) 2007-05-16 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 (5 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-20100324128-A1 9, 10-Alpha, Alpha-OH-Taxane Analogs and Methods for Production Thereof ADCY9, TECR, AKR1C3 KDM4E 4736/4885TDP1 2323/4885REV1 1402/4885
US-20120077871-A1 9, 10-Alpha, Alpha-OH-Taxane Analogs and Methods for Production Thereof TECR, ADCY9, AKR1C3 KDM4E 4743/4885TDP1 2434/4885REV1 1485/4885
US-20150133536-A1 9, 10-Alpha, Alpha-OH-Taxane Analogs and Methods for Production Thereof TECR, ADCY9, AKR1C3 KDM4E 4743/4885TDP1 2434/4885REV1 1485/4885
US-20180125811-A1 9,10-Alpha,Alpha-OH-Taxane Analogs and Methods for Production Thereof TECR, ADCY9, AKR1C3 KDM4E 4743/4885TDP1 2434/4885REV1 1485/4885
US-20160331718-A1 9, 10-ALPHA, ALPHA-OH-TAXANE ANALOGS AND METHOD FOR PRODUCTION THEREOF TECR, ADCY9, AKR1C3 KDM4E 4767/4885TDP1 2565/4885REV1 1558/4885

“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.