SCHEMBL7044324

SCHEMBL7044324

COc1ccc(-c2ccc(Cl)s2)n2nc(NC(=O)c3ccc(C)s3)nc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
LMNA P02545 3/20 0.37
NAMPT P43490 1/20 0.37
IMPDH2 P12268 1/20 0.36
TP53 P04637 2/20 0.36
MAPT P10636 2/20 0.36
MEN1 O00255 7/20 0.35
NPC1 O15118 7/20 0.35
RAB9A P51151 7/20 0.35
POLB P06746 2/20 0.35
ALDH1A1 P00352 6/20 0.35
KDM4E B2RXH2 5/20 0.35
HPGD P15428 3/20 0.35
GAA P10253 1/20 0.35
HSD17B10 Q99714 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
TSHR P16473 1/20 0.34

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
SCHEMBL7767039 0.86 SMN1; SMN2 (0.46) KMT2ASMN1; SMN2LMNANAMPTIMPDH2
SCHEMBL7766248 0.84 SMN1; SMN2 (0.49) KMT2ASMN1; SMN2LMNANAMPTIMPDH2
SCHEMBL7765412 0.83 SMN1; SMN2 (0.47) KMT2ASMN1; SMN2LMNANAMPTIMPDH2
SCHEMBL7146644 0.83 SMN1; SMN2 (0.53) KMT2ASMN1; SMN2LMNATP53MAPT
SCHEMBL7762456 0.83 SMN1; SMN2 (0.45) KMT2ASMN1; SMN2MAPT
SCHEMBL7044467 0.82 SMN1; SMN2 (0.49) KMT2ASMN1; SMN2LMNANAMPTIMPDH2
SCHEMBL7766259 0.82 SMN1; SMN2 (0.51) KMT2ASMN1; SMN2LMNANAMPTIMPDH2
SCHEMBL7762515 0.81 SMN1; SMN2 (0.45) KMT2ASMN1; SMN2LMNANAMPTIMPDH2
SCHEMBL7767933 0.80 SMN1; SMN2 (0.44) KMT2ASMN1; SMN2LMNANAMPTIMPDH2
SCHEMBL7766251 0.80 SMN1; SMN2 (0.47) SMN1; SMN2LMNANAMPTTP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1412352-A1 8-METHOXY-(1,2,4)TRIAZOLO(1,5-A)PYRIDINE DERIVATIVES AND THEIR USE AS ADENOSINE RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2004-04-28 EP claimed
WO-2003010167-A1 8-METHOXY-(1,2,4)TRIAZOLO(1,5-A)PYRIDINE DERIVATIVES AND THEIR USE AS ADENOSINE RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2003-02-06 WO claimed
US-6514989-B1 Has a good affinity to the adenosine receptor and can therefore be used for the treatment or protection of diseases mediated by this receptor HOFFMANN-LA ROCHE INC. 2003-02-04 US disclosed
US-6514989-B1 Has a good affinity to the adenosine receptor and can therefore be used for the treatment or protection of diseases mediated by this receptor HOFFMANN-LA ROCHE INC. 2003-02-04 US disclosed