SCHEMBL2192291

SCHEMBL2192291

OC(c1ccccc1)c1ccc2[nH]cnc2n1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.48
MAPK14 Q16539 1/20 0.42
CTSA P10619 2/20 0.40
CDK2 P24941 1/20 0.40
PRMT5 O14744 1/20 0.38
LMNA P02545 2/20 0.36
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 2/20 0.34
HSD17B10 Q99714 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HPGD P15428 2/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
AKT2 P31751 1/20 0.33
MLKL Q8NB16 1/20 0.33
ADORA3 P0DMS8 2/20 0.33
ADORA2A P29274 2/20 0.33
ADORA1 P30542 2/20 0.33

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
SCHEMBL2192510 0.79 CTSA (0.39) SLC2A1MAPK14CTSACDK2KDM4E
SCHEMBL2188610 0.78 MAPK14 (0.39) SLC2A1MAPK14CTSACDK2LMNA
SCHEMBL5033486 0.77 CDK2 (0.49) SLC2A1MAPK14CTSACDK2PRMT5
SCHEMBL2219082 0.76 MAPK14 (0.38) SLC2A1MAPK14CTSACDK2LMNA
SCHEMBL2217811 0.74 CTSA (0.39) SLC2A1MAPK14CTSACDK2LMNA
SCHEMBL14032681 0.73 ALDH1A1 (0.40) MAPK14CTSACDK2LMNAKDM4E
SCHEMBL13373326 0.70 SMN1; SMN2 (0.41) SLC2A1PRMT5KDM4EALDH1A1SMN1; SMN2
SCHEMBL30437840 0.69 SMN1; SMN2 (0.47) LMNAKDM4EALDH1A1SMN1; SMN2HPGD
SCHEMBL2008301 0.68 ALDH1A1 (0.45) MAPK14CTSACDK2LMNAKDM4E
SCHEMBL28933357 0.67 LMNA (0.52) SLC2A1LMNAKDM4EALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2519522-A2 SUBSTITUTED IMIDAZOPYRIDINYL-AMINOPYRIDINE COMPOUNDS ArQule, Inc. (US) 2012-11-07 EP disclosed
US-20110172203-A1 Substituted Imidazopyridinyl-Aminopyridine Compounds ARQULE, INC. (US) 2011-07-14 US disclosed
WO-2011082270-A2 SUBSTITUTED IMIDAZOPYRIDINYL-AMINOPYRIDINE COMPOUNDS ARQULE. INC. (US) 2011-07-07 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-20110172203-A1 Substituted Imidazopyridinyl-Aminopyridine Compounds MKI67, CDK4, ABL1 SLC2A1 2458/4885MAPK14 3207/4885CTSA 4514/4885

“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.