SCHEMBL14964976

SCHEMBL14964976

Clc1ncc2c(-c3ccccc3)c(Br)sc2n1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.34
MAPT P10636 3/20 0.34
KDM4E B2RXH2 2/20 0.34
MAPK1 P28482 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HTT P42858 1/20 0.33
ABL1 P00519 1/20 0.33
BCR P11274 1/20 0.33
SMN1; SMN2 Q16637 4/20 0.33
ALDH1A1 P00352 3/20 0.33
HPGD P15428 3/20 0.33
PIN1 Q13526 3/20 0.33
NPC1 O15118 2/20 0.33
POLB P06746 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 2/20 0.32
GLA P06280 1/20 0.32
KDR P35968 1/20 0.31
LIMK1 P53667 1/20 0.31

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
SCHEMBL27660790 0.82 ALDH1A1 (0.46) L3MBTL1MAPTKDM4EMAPK1TDP1
SCHEMBL2369352 0.75 ATM (0.37) L3MBTL1MAPTKDM4EMAPK1TDP1
SCHEMBL2368300 0.70 ESR1 (0.47) MAPTKDM4EMAPK1HTTABL1
SCHEMBL17044919 0.69 GPR3 (0.45) L3MBTL1MAPTKDM4ESMN1; SMN2ALDH1A1
SCHEMBL14965012 0.68 SMN1; SMN2 (0.42) L3MBTL1MAPTMAPK1HTTABL1
SCHEMBL22249681 0.68 MAPT (0.30) MAPT
SCHEMBL2859453 0.66 ALDH1A1 (0.43) L3MBTL1MAPTKDM4EMAPK1TDP1
SCHEMBL14422883 0.65 KDM4E (0.52) L3MBTL1MAPTKDM4ETDP1HTT
SCHEMBL18199585 0.62 TNF (0.46) L3MBTL1MAPTKDM4ESMN1; SMN2ALDH1A1
SCHEMBL15391391 0.62 ALDH1A1 (0.40) L3MBTL1MAPTKDM4EMAPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160152634-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS XENTION LTD (GB) 2016-06-02 US disclosed
US-9290511-B2 Thieno-pyrimidines, useful as potassium channel inhibitors XENTION LIMITED (GB) 2016-03-22 US disclosed
US-20140371203-A1 Thieno- and furo - pyrimidines and pyridines, useful as potassium channel inhibitors XENTION LIMITED (GB) 2014-12-18 US disclosed
EP-2780343-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS Xention Limited (GB) 2014-09-24 EP disclosed
WO-2013072694-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS XENTION LIMITED (GB) 2013-05-23 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-20140371203-A1 Thieno- and furo - pyrimidines and pyridines, useful as potassium channel inhibitors KCNA3, KCNJ1, KCNJ11 L3MBTL1 2713/4885MAPT 2780/4885KDM4E 897/4885
US-20160152634-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS KCNA3, KCNJ1, KCNJ11 L3MBTL1 2779/4885MAPT 2726/4885KDM4E 809/4885

“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.