SCHEMBL9106417

SCHEMBL9106417

O=C(Nc1ccccn1)C(CC1CCCC1)N1C(=O)Cc2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GCK P35557 9/20 0.53
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 1/20 0.41
CDK1 P06493 1/20 0.40
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40
CDK5 Q00535 1/20 0.40
CDK5R1 Q15078 1/20 0.40
GAA P10253 1/20 0.39

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
SCHEMBL9908077 0.89 GCK (0.53) GCKCDK5CDK5R1GAA
SCHEMBL9103500 0.89 GCK (0.53) GCKCDK5CDK5R1GAA
SCHEMBL9105910 0.89 GCK (0.51) GCKKDM4E
SCHEMBL9106250 0.89 GCK (0.51) GCKKDM4E
SCHEMBL9103451 0.89 GCK (0.51) GCKKDM4EALDH1A1
SCHEMBL9108882 0.89 GCK (0.51) GCKKDM4E
SCHEMBL9103429 0.89 GCK (0.51) GCKKDM4EALDH1A1
SCHEMBL9103261 0.89 GCK (0.53) GCKKDM4E
SCHEMBL9104469 0.89 GCK (0.53) GCKKDM4E
SCHEMBL9104882 0.86 GCK (0.53) GCKKDM4EALDH1A1

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
US-20120142705-A1 ISATIN AND OXINDOLE COMPOUNDS KESTER ROBERT FRANCIS (US) 2012-06-07 US claimed
US-20120142705-A1 ISATIN AND OXINDOLE COMPOUNDS KESTER ROBERT FRANCIS (US) 2012-06-07 US disclosed
US-20120142705-A1 ISATIN AND OXINDOLE COMPOUNDS KESTER ROBERT FRANCIS (US) 2012-06-07 US disclosed
US-20120142705-A1 ISATIN AND OXINDOLE COMPOUNDS KESTER ROBERT FRANCIS (US) 2012-06-07 US 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-20120142705-A1 ISATIN AND OXINDOLE COMPOUNDS GPR119, INSR, OAT GCK 488/4885KDM4E 4421/4885ALDH1A1 646/4885

“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.