SCHEMBL4143386

SCHEMBL4143386

CC(C)(C)OC(=O)N1CCCC1C(O)c1cccnc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.47
CYP3A4 P08684 1/20 0.43
CYP3A5 P20815 1/20 0.43
KDM4E B2RXH2 2/20 0.42
BLM P54132 1/20 0.42
ALOX15 P16050 1/20 0.42
UCHL1 P09936 2/20 0.41
POLB P06746 2/20 0.40
CHRNB4 P30926 2/20 0.40
CHRNA3 P32297 2/20 0.40
NPC1 O15118 1/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNA4 P43681 1/20 0.40
HSD17B10 Q99714 1/20 0.39
FKBP1A P62942 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
SCHEMBL3442475 0.97 GPR119 (0.47) GPR119CYP3A4CYP3A5KDM4EBLM
SCHEMBL4153235 0.86 NPC1 (0.45) GPR119UCHL1NPC1HSD17B10
SCHEMBL28194949 0.86 KLK7 (0.45) GPR119BLMUCHL1NPC1HSD17B10
SCHEMBL13997813 0.86 KLK7 (0.45) GPR119BLMUCHL1NPC1HSD17B10
SCHEMBL29997863 0.86 KLK7 (0.45) GPR119BLMUCHL1NPC1HSD17B10
SCHEMBL1843454 0.86 KLK7 (0.45) GPR119BLMUCHL1NPC1HSD17B10
SCHEMBL8224323 0.86 GPR119 (0.51) GPR119CYP3A4KDM4E
SCHEMBL1795627 0.82 GPR119 (0.43) GPR119BLMUCHL1NPC1HSD17B10
SCHEMBL3443002 0.82 GPR119 (0.43) GPR119BLMUCHL1NPC1HSD17B10
SCHEMBL25969334 0.82 GPR119 (0.43) GPR119BLMUCHL1NPC1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8329686-B2 Isatin analogues and uses therefor WASHINGTON UNIVERSITY (US) 2012-12-11 US disclosed
US-20090068105-A1 ISATIN ANALOGUES AND USES THEREFOR WASHINGTON UNIVERSITY IN ST. LOUIS 2009-03-12 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-20090068105-A1 ISATIN ANALOGUES AND USES THEREFOR CASP7, CASP3, HASPIN GPR119 495/4885CYP3A4 2033/4885CYP3A5 2697/4885

“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.