SCHEMBL9106076

SCHEMBL9106076

Cc1ccc2c(c1)C(=O)C(=O)N2C(CC(C)C)C(=O)Nc1nccs1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GCK P35557 7/20 0.66
ALDH1A1 P00352 5/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
FFAR2 O15552 1/20 0.45
TP53 P04637 2/20 0.44
MAPK1 P28482 1/20 0.44
HSPA5 P11021 1/20 0.43
HSPA2 P54652 1/20 0.43
HTT P42858 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
LMNA P02545 1/20 0.42
XBP1 P17861 1/20 0.42
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL9103438 0.90 GCK (0.64) GCKALDH1A1NPC1RAB9AMEN1
SCHEMBL9106679 0.90 GCK (0.64) GCKALDH1A1NPC1RAB9AMEN1
SCHEMBL9103462 0.88 GCK (0.62) GCKALDH1A1NPC1RAB9AMEN1
SCHEMBL9107973 0.87 GCK (0.79) GCKALDH1A1NPC1RAB9AMEN1
SCHEMBL9105720 0.85 GCK (0.58) GCKALDH1A1NPC1RAB9AMEN1
SCHEMBL9103861 0.85 GCK (0.66) GCKALDH1A1NPC1RAB9AMEN1
SCHEMBL9106273 0.84 GCK (0.61) GCK
SCHEMBL9106638 0.82 GCK (0.59) GCKALDH1A1NPC1RAB9AMEN1
SCHEMBL9108285 0.82 GCK (0.46) GCKALDH1A1NPC1RAB9ALMNA
SCHEMBL9106920 0.81 GCK (0.44) GCKALDH1A1NPC1RAB9AKMT2A

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 488/4885ALDH1A1 646/4885NPC1 2165/4885

“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.