SCHEMBL6784535

SCHEMBL6784535

CCOC(=O)c1oncc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
CYP1A2 P05177 3/20 0.42
TSHR P16473 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.40
AHR P35869 1/20 0.40
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40
CA12 O43570 3/20 0.39
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA7 P43166 3/20 0.39
CA9 Q16790 3/20 0.39
CA14 Q9ULX7 3/20 0.39
ESR1 P03372 1/20 0.39

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
SCHEMBL20267708 0.88 ALDH1A1 (0.43) L3MBTL1TSHRCYP2C9CYP2C19ALDH1A1
SCHEMBL31272272 0.82 CA12 (0.41) L3MBTL1CYP1A2TSHRCYP2C9CYP2C19
SCHEMBL31299641 0.82 CYP2C9 (0.46) L3MBTL1CYP1A2TSHRCYP2C9CYP2C19
SCHEMBL22005649 0.79 TDP1 (0.51) L3MBTL1TSHRALDH1A1KMT2ANPC1
SCHEMBL31519462 0.77 ALDH1A1 (0.46) ALDH1A1KMT2AKDM4ENPC1MAPT
SCHEMBL31299630 0.77 MAPK1 (0.40) L3MBTL1CYP1A2TSHRCYP2C9CYP2C19
SCHEMBL19919916 0.77 CYP19A1 (0.33) CYP2C9CYP2C19MEN1KMT2AKDM4E
SCHEMBL3884597 0.74 TSHR (0.50) L3MBTL1CYP1A2TSHRCYP2C9CYP2C19
SCHEMBL3989960 0.74
SCHEMBL16093636 0.74 PRKCZ (0.49) L3MBTL1MEN1ALDH1A1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10392389-B2 Heterocyclic compounds for the inhibition of PASK BIOENERGENIX LLC (US) 2019-08-27 US disclosed
US-10392389-B2 Heterocyclic compounds for the inhibition of PASK BIOENERGENIX LLC (US) 2019-08-27 US disclosed
US-20150284395-A1 HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF PASK BIOENERGENIX LLC 2015-10-08 US disclosed
US-20150284395-A1 HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF PASK BIOENERGENIX LLC 2015-10-08 US disclosed
US-20150284395-A1 HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF PASK BIOENERGENIX LLC 2015-10-08 US disclosed
WO-2014066795-A1 HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF PASK BIOENERGENIX (US) 2014-05-01 WO disclosed
WO-2014066795-A1 HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF PASK BIOENERGENIX (US) 2014-05-01 WO disclosed
US-6809101-B2 RNA POLYMERASES INHIBITORS; SUCH AS 5-(1-HYDROXY-1-(5-METHYL-OXAZOL-2-YL))METHYLENE-2-THIOXOTHIAZOLIDIN-4-ONE SHIONOGI & CO., LTD. (JP) 2004-10-26 US disclosed
US-20030203948-A1 Compounds having anti-hepatitics c virus effect Z-KAT, INC. 2003-10-30 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 (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-10392389-B2 Heterocyclic compounds for the inhibition of PASK PASK, PDXK, PANK2 L3MBTL1 4311/4885CYP1A2 4287/4885TSHR 3180/4885
US-20150284395-A1 HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF PASK PASK, PDXK, PANK2 L3MBTL1 4311/4885CYP1A2 4287/4885TSHR 3180/4885
US-20030203948-A1 Compounds having anti-hepatitics c virus effect NSUN3, HCCS, NSUN2 L3MBTL1 604/4885CYP1A2 816/4885TSHR 2415/4885

“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.