SCHEMBL2404646

SCHEMBL2404646

Nc1cccnc1OC1CCOC1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 12/20 0.54
LRRK2 Q5S007 2/20 0.49
ALOX5AP P20292 2/20 0.45
FEN1 P39748 2/20 0.45
FFAR2 O15552 2/20 0.42
FFAR4 Q5NUL3 1/20 0.42

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
SCHEMBL2406994 1.00 GRM4 (0.54) GRM4LRRK2ALOX5APFEN1FFAR2
SCHEMBL2404642 1.00 GRM4 (0.54) GRM4LRRK2ALOX5APFEN1FFAR2
SCHEMBL2408814 0.91 GRM4 (0.47) GRM4LRRK2ALOX5APFEN1
SCHEMBL19172439 0.91 GRM4 (0.47) GRM4LRRK2ALOX5APFEN1
SCHEMBL2408815 0.91 GRM4 (0.47) GRM4LRRK2ALOX5APFEN1
SCHEMBL29445482 0.91 GRM4 (0.53) GRM4LRRK2ALOX5APFEN1
SCHEMBL1936639 0.91 GRM4 (0.53) GRM4LRRK2ALOX5APFEN1
Trifluoroacetic Acid SCHEMBL2407542 0.88 GRM4 (0.56) GRM4LRRK2FFAR2FFAR4
SCHEMBL20689295 0.87 GRM4 (0.42) GRM4LRRK2ALOX5APFEN1FFAR4
SCHEMBL20687907 0.82 ALOX5AP (0.43) GRM4ALOX5APFEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2539346-B1 4-[HETEROCYCLOALKYLOXY(HETERO)ARYLAMINO] THIENO[2,3-D]PYRIMIDINES HAVING MNK1/ MNK2 INHIBITING ACTIVITY FOR PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INT (DE) 2014-04-16 EP disclosed
US-8648068-B2 Heterocycloalkyl-containing thienopyrimidines for pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-02-11 US disclosed
EP-2539346-A1 HETEROCYCLOALKYL-CONTAINING THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS Boehringer Ingelheim International GmbH (DE) 2013-01-02 EP disclosed
WO-2011104337-A1 HETEROCYCLOALKYL-CONTAINING THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-09-01 WO disclosed
US-20110212102-A1 HETEROCYCLOALKYL-CONTAINING THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-09-01 US disclosed
WO-2011104337-A1 HETEROCYCLOALKYL-CONTAINING THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-09-01 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 (1 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-20110212102-A1 HETEROCYCLOALKYL-CONTAINING THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DTYMK, TNK2, CMPK1 GRM4 3896/4885LRRK2 985/4885ALOX5AP 2162/4885

“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.