SCHEMBL10530438

SCHEMBL10530438

COCCN1C(=O)OC(C)(C)c2cc3[nH]c(-c4ccc(O)cc4)nc3cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GUSB P08236 2/20 0.40
TOP1 P11387 2/20 0.40
TOP2A P11388 2/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NPBWR1 P48145 1/20 0.39
SCD O00767 1/20 0.39
AURKB Q96GD4 2/20 0.38
AURKA O14965 1/20 0.38
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37
MTOR P42345 1/20 0.37
KDM4E B2RXH2 1/20 0.36
POLB P06746 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
SCHEMBL10531308 0.91 SLC2A1 (0.44) GUSBALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL10532657 0.90 GUSB (0.41) GUSBTOP1TOP2AALDH1A1HPGD
SCHEMBL10646224 0.90 PDE4A (0.49) GUSBALDH1A1HPGDHSD17B10SCD
SCHEMBL10532282 0.88 AURKB (0.46) GUSBTOP1TOP2AALDH1A1HPGD
SCHEMBL10650118 0.85 GUSB (0.45) GUSBTOP1TOP2AALDH1A1HPGD
SCHEMBL10645372 0.84 ALDH1A1 (0.45) GUSBALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL10534419 0.84 SLC2A1 (0.43) GUSBALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL10649604 0.83 SLC2A1 (0.44) GUSBALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL10698967 0.83 AURKB (0.47) GUSBTOP1TOP2AALDH1A1HPGD
SCHEMBL10530386 0.81 SLC2A1 (0.43) GUSBALDH1A1HPGDSMN1; SMN2HSD17B10

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-4831027-A USEFUL IN TREATMENT OF CARDIOVASCULAR DISORDERS DR. KARL THOMAE GMBH (DE) 1989-05-16 US disclosed
EP-0263352-A1 Imidazo-benzoxazinones, their preparation and medicaments containing these compounds Dr. Karl Thomae GmbH (DE) 1988-04-13 EP disclosed