SCHEMBL9101953

SCHEMBL9101953

CC(C)CC(C(=O)Nc1nccs1)N1C(=O)C(=O)c2c(Cl)cccc21

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GCK P35557 4/20 0.66
FFAR2 O15552 5/20 0.50
HSPA5 P11021 1/20 0.46
HSPA2 P54652 1/20 0.46
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
LMNA P02545 5/20 0.43
XBP1 P17861 1/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
RAB9A P51151 1/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.41
HPGD P15428 1/20 0.41
ACP1 P24666 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
SCHEMBL9107973 0.85 GCK (0.79) GCKFFAR2HSPA5HSPA2MEN1
SCHEMBL9104134 0.84 GCK (0.55) GCK
SCHEMBL9106852 0.83 GCK (0.61) GCKFFAR2HSPA5HSPA2MEN1
SCHEMBL9103861 0.83 GCK (0.66) GCKFFAR2HSPA5HSPA2MEN1
SCHEMBL9105927 0.82 GCK (0.45) GCKFFAR2MEN1KMT2ALMNA
SCHEMBL9103438 0.82 GCK (0.64) GCKFFAR2HSPA5HSPA2MEN1
SCHEMBL9106900 0.81 KDM4E (0.44) GCKFFAR2MEN1KMT2ANPC1
SCHEMBL9908079 0.81 KDM4E (0.44) GCKFFAR2MEN1KMT2ANPC1
SCHEMBL1317245 0.79 GCK (1.00) GCKFFAR2HSPA5HSPA2MEN1
SCHEMBL9106076 0.79 GCK (0.66) GCKFFAR2HSPA5HSPA2MEN1

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 488/4885FFAR2 627/4885HSPA5 1634/4885

“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.