SCHEMBL6165737

SCHEMBL6165737

COC(=O)CCC1CCCN1C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.43
NPC1 O15118 1/20 0.41
OPRD1 P41143 1/20 0.41
ALDH1A1 P00352 2/20 0.40
FPR3 P25089 1/20 0.40
FPR2 P25090 1/20 0.40
LMNA P02545 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
KDM1A O60341 1/20 0.39
PDE8B O95263 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 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
SCHEMBL6165730 1.00 ATM (0.46) ATMSMN1; SMN2HSD17B10NPC1OPRD1
SCHEMBL7989798 0.96 ATM (0.47) ATMSMN1; SMN2HSD17B10NPC1OPRD1
SCHEMBL6157710 0.96 ATM (0.47) ATMSMN1; SMN2HSD17B10NPC1OPRD1
SCHEMBL29039395 0.92 SMN1; SMN2 (0.42) ATMSMN1; SMN2HSD17B10NPC1OPRD1
SCHEMBL29039393 0.92 SMN1; SMN2 (0.42) ATMSMN1; SMN2HSD17B10NPC1OPRD1
SCHEMBL29039237 0.91 SMN1; SMN2 (0.41) ATMSMN1; SMN2HSD17B10NPC1OPRD1
SCHEMBL29039235 0.91 SMN1; SMN2 (0.41) ATMSMN1; SMN2HSD17B10NPC1OPRD1
SCHEMBL702497 0.88 ATM (0.43) ATMSMN1; SMN2HSD17B10OPRD1KDM1A
SCHEMBL16551790 0.86 ATM (0.47) ATMSMN1; SMN2HSD17B10OPRD1ALDH1A1
SCHEMBL6921210 0.86 ATM (0.47) ATMSMN1; SMN2HSD17B10OPRD1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116234802-A Quinoline CGAS antagonist compounds 免疫传感器治疗股份有限公司 2023-06-06 CN disclosed
EP-1129070-A4 NEUROTROPHIC DIAMIDE AND CARBAMATE AGENTS BRISTOL MYERS SQUIBB CO (US) 2005-03-02 EP disclosed
EP-1129070-A1 NEUROTROPHIC DIAMIDE AND CARBAMATE AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2001-09-05 EP disclosed
US-6228872-B1 PEPTIDE-PROLYL ISOMERASE AND ROTAMASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2001-05-08 US disclosed
WO-2000027811-A1 NEUROTROPHIC DIAMIDE AND CARBAMATE AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2000-05-18 WO disclosed