SCHEMBL1370802

SCHEMBL1370802

COc1ccc(-c2ccc(OC)c(=O)cc2)c(OC)c1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.53
HDAC2 Q92769 1/20 0.53
HDAC8 Q9BY41 1/20 0.53
ERN1 O75460 1/20 0.48
ALDH1A1 P00352 3/20 0.46
HPGD P15428 3/20 0.46
KDM4E B2RXH2 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
TUBB4A P04350 3/20 0.43
TUBB P07437 3/20 0.43
TUBA3C P0DPH7 3/20 0.43
TUBA1B P68363 3/20 0.43
TUBA4A P68366 3/20 0.43
TUBB4B P68371 3/20 0.43
TUBB3 Q13509 3/20 0.43
TUBB2A Q13885 3/20 0.43
TUBB8 Q3ZCM7 3/20 0.43
TUBA3E Q6PEY2 3/20 0.43

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
SCHEMBL29364192 1.00 HDAC4 (0.53) HDAC4HDAC2HDAC8ERN1ALDH1A1
SCHEMBL4579619 0.79 HDAC4 (0.53) HDAC4HDAC2HDAC8ERN1ALDH1A1
SCHEMBL29788008 0.79 HDAC4 (0.53) HDAC4HDAC2HDAC8ERN1ALDH1A1
SCHEMBL2044179 0.77 CA1 (0.51) ERN1NPC1RAB9ALMNAMAPT
SCHEMBL29788180 0.77 CA1 (0.51) ERN1NPC1RAB9ALMNAMAPT
SCHEMBL6769062 0.77 ERN1 (0.48) HDAC4HDAC2HDAC8ERN1ALDH1A1
SCHEMBL642228 0.77 HDAC4 (0.58) HDAC4HDAC2HDAC8ERN1ALDH1A1
SCHEMBL29868499 0.76 KDM4E (0.56) ERN1KDM4EMAPTHSD17B10
SCHEMBL6773146 0.76 KDM4E (0.56) ERN1KDM4EMAPTHSD17B10
SCHEMBL7260001 0.76 ERN1 (0.49) HDAC4HDAC2HDAC8ERN1ALDH1A1

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
US-20140121233-A1 Synthesis and Characterization of Second Generation Benzofuranone Ring Substituted Noscapine Analogs GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2014-05-01 US disclosed
US-8426398-B2 Conjugates of noscapine and folic acid and their use in treating cancer EMORY UNIVERSITY (US) 2013-04-23 US disclosed
US-20110286919-A1 CONJUGATES OF NOSCAPINE AND FOLIC ACID AND THEIR USE IN TREATING CANCER EMORY UNIVERSITY (US) 2011-11-24 US disclosed
WO-2010083104-A2 CONJUGATES OF NOSCAPINE AND FOLIC ACID AND THEIR USE IN TREATING CANCER EMORY UNIVERSITY (US) 2010-07-22 WO disclosed
US-6673814-B2 CONTROLLED-RELEASE BY IMPLANTABLE DEVICES, DELIVERY PUMPS, WAFERS, AND BIODEGRADABLE POLYMERS EMORY UNIVERSITY 2004-01-06 US disclosed
US-20020137762-A1 Delivery systems and methods for noscapine and noscapine derivatives, useful as anticancer agents EMORY UNIVERSITY 2002-09-26 US disclosed
US-6376516-B1 FOR TREATING NEOPLASTIC CANCERS INCLUDING COLON, LUNG, BRAIN, OVARIAN, PROSTATE, BREAST, AND BLADDER CANCER AND LEUKEMIA; LOW TOXICITY EMORY UNIVERSITY 2002-04-23 US disclosed
WO-1999008528-A1 NOSCAPINE DERIVATIVES, USEFUL AS ANTICANCER AGENTS EMORY UNIVERSITY (US) 1999-02-25 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 (3 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-20020137762-A1 Delivery systems and methods for noscapine and noscapine derivatives, useful as anticancer agents NOS1, NOS2, HCCS HDAC4 1246/4885HDAC2 1778/4885HDAC8 1850/4885
US-20140121233-A1 Synthesis and Characterization of Second Generation Benzofuranone Ring Substituted Noscapine Analogs MAP2, MAP4, TUBB1 HDAC4 269/4885HDAC2 618/4885HDAC8 556/4885
US-20110286919-A1 CONJUGATES OF NOSCAPINE AND FOLIC ACID AND THEIR USE IN TREATING CANCER FOLR1, FOLR2, DHFR HDAC4 4199/4885HDAC2 4468/4885HDAC8 4078/4885

“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.