SCHEMBL134640

SCHEMBL134640

COc1ccc(C(=O)c2c(N)sc3c2CCC3)cc1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.67
KMT2A Q03164 3/20 0.67
TDP1 Q9NUW8 1/20 0.67
MAPT P10636 7/20 0.66
ALDH1A1 P00352 6/20 0.66
HPGD P15428 3/20 0.66
GAA P10253 2/20 0.66
LMNA P02545 1/20 0.66
ADORA1 P30542 1/20 0.59
KDM4E B2RXH2 4/20 0.58
FLT3 P36888 1/20 0.58
GLO1 Q04760 1/20 0.56
RECQL P46063 1/20 0.55
HSD17B10 Q99714 3/20 0.51
USP2 O75604 1/20 0.51
ALOX15 P16050 2/20 0.50
MAPK1 P28482 1/20 0.50

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
SCHEMBL4060800 0.97 TDP1 (0.71) MEN1KMT2ATDP1MAPTALDH1A1
SCHEMBL4060445 0.88 TDP1 (0.65) MEN1KMT2ATDP1MAPTALDH1A1
SCHEMBL133029 0.86 TDP1 (0.70) MEN1KMT2ATDP1MAPTALDH1A1
SCHEMBL3777713 0.85 TDP1 (0.69) MEN1KMT2ATDP1MAPTALDH1A1
SCHEMBL4060747 0.84 TDP1 (0.67) MEN1KMT2ATDP1MAPTALDH1A1
SCHEMBL4057532 0.83 TDP1 (0.70) MEN1KMT2ATDP1MAPTALDH1A1
SCHEMBL136844 0.83 TDP1 (0.74) MEN1KMT2ATDP1MAPTALDH1A1
SCHEMBL138601 0.83 TDP1 (0.94) MEN1KMT2ATDP1MAPTALDH1A1
SCHEMBL6096038 0.83 MEN1 (0.63) MEN1KMT2ATDP1MAPTALDH1A1
SCHEMBL136108 0.82 MAPT (0.94) MEN1KMT2ATDP1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2430029-B1 THIENO[2,3-B]PYRIDINE DERIVATIVES AS VIRAL REPLICATION INHIBITORS UNIV LEUVEN KATH (BE) 2018-01-10 EP disclosed
US-9499563-B2 Thieno [2, 3-B] pyridine derivatives as viral replication inhibitors KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2016-11-22 US disclosed
US-20140296272-A1 THIENO [2, 3-B] PYRIDINE DERIVATIVES AS VIRAL REPLICATION INHIBITORS CISTIM LEUVEN VZW (BE) 2014-10-02 US disclosed
US-8785638-B2 Thieno [2, 3-B] pyridine derivatives as viral replication inhibitors KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2014-07-22 US disclosed
US-20120059028-A1 THIENO [2, 3-B] PYRIDINE DERIVATIVES AS VIRAL REPLICATION INHIBITORS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2012-03-08 US disclosed
EP-1828199-B1 THIENO-PYRIDINE DERIVATIVES AS GABA-B ALLOSTERIC ENHANCERS HOFFMANN LA ROCHE (CH) 2009-05-06 EP disclosed
US-7390903-B2 Thieno-pyridine derivatives as allosteric enhancers of the GABAB receptors HOFFMANN-LA ROCHE INC. (US) 2008-06-24 US disclosed
EP-1828199-A1 THIENO-PYRIDINE DERIVATIVES AS GABA-B ALLOSTERIC ENHANCERS F. Hoffmann-Roche AG (CH) 2007-09-05 EP disclosed
US-20060135552-A1 Thieno-pyridine derivatives as allosteric enhancers of the GABAB receptors HOFFMANN-LA ROCHE INC. 2006-06-22 US disclosed
WO-2006063732-A1 THIENO-PYRIDINE DERIVATIVES AS GABA-B ALLOSTERIC ENHANCERS F.HOFFMANN-LA ROCHE AG (CH) 2006-06-22 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-20060135552-A1 Thieno-pyridine derivatives as allosteric enhancers of the GABAB receptors GABBR1, CHRNA5, CHRNA3 MEN1 4709/4885KMT2A 3171/4885TDP1 965/4885
US-20140296272-A1 THIENO [2, 3-B] PYRIDINE DERIVATIVES AS VIRAL REPLICATION INHIBITORS TYMP, DUT, MAVS MEN1 4548/4885KMT2A 2903/4885TDP1 928/4885
US-20120059028-A1 THIENO [2, 3-B] PYRIDINE DERIVATIVES AS VIRAL REPLICATION INHIBITORS TYMP, DUT, MAVS MEN1 4548/4885KMT2A 2903/4885TDP1 928/4885

“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.