SCHEMBL9106414

SCHEMBL9106414

Cn1ccc(NC(=O)C(CC2CCCC2)N2C(=O)Cc3ccc(Br)cc32)n1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GCK P35557 18/20 0.53
CDK5 Q00535 1/20 0.37
CDK5R1 Q15078 1/20 0.37
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36

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
SCHEMBL9107717 0.93 GCK (0.53) GCKCDK5CDK5R1CHRM2CHRM4
SCHEMBL9105143 0.90 GCK (0.53) GCK
SCHEMBL9108683 0.90 GCK (0.53) GCK
SCHEMBL9106742 0.90 GCK (0.53) GCKCDK5CDK5R1CHRM2CHRM4
SCHEMBL9106140 0.87 GCK (0.54) GCKCDK5CDK5R1CHRM2CHRM4
SCHEMBL9106805 0.85 GCK (0.53) GCK
SCHEMBL9107017 0.84 GCK (0.53) GCK
SCHEMBL9103429 0.83 GCK (0.51) GCK
SCHEMBL9101677 0.83 GCK (0.53) GCK
SCHEMBL9908123 0.82 GCK (0.52) GCKCDK5CDK5R1

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 488/4885CDK5 992/4885CDK5R1 1455/4885

“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.