SCHEMBL11248955

SCHEMBL11248955

CC(C)(C)c1ccc(C2CC(=O)c3ccccc3O2)cc1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.72
ADORA3 P0DMS8 3/20 0.72
AR P10275 2/20 0.72
KDM4E B2RXH2 1/20 0.72
CYP19A1 P11511 1/20 0.72
HSD17B10 Q99714 1/20 0.72
NPC1 O15118 3/20 0.68
RAB9A P51151 3/20 0.68
MAPT P10636 2/20 0.68
CYP3A4 P08684 1/20 0.68
MAPK1 P28482 1/20 0.68
GUSB P08236 2/20 0.54
HSD11B1 P28845 1/20 0.52
AKR1C3 P42330 1/20 0.52

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
SCHEMBL11248956 1.00 MAOB (0.72) MAOBADORA3ARKDM4ECYP19A1
Flavanone SCHEMBL19745 0.85 MAOB (1.00) MAOBADORA3ARKDM4ECYP19A1
Flavanone SCHEMBL12660199 0.85 MAOB (1.00) MAOBADORA3ARKDM4ECYP19A1
Flavanone SCHEMBL12189591 0.85 MAOB (1.00) MAOBADORA3ARKDM4ECYP19A1
Flavanone SCHEMBL29470801 0.85 MAOB (1.00) MAOBADORA3ARKDM4ECYP19A1
Flavanone SCHEMBL29843289 0.85 MAOB (1.00) MAOBADORA3ARKDM4ECYP19A1
SCHEMBL12251332 0.84 AR (0.64) MAOBADORA3ARKDM4ECYP19A1
SCHEMBL1890730 0.84 MAOB (1.00) MAOBADORA3ARKDM4ECYP19A1
SCHEMBL1890733 0.84 MAOB (1.00) MAOBADORA3ARKDM4ECYP19A1
Flavanone SCHEMBL11733114 0.83 MAOB (0.96) MAOBADORA3ARKDM4ECYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0025161-B1 3-METHYLENE FLAVANONES AND 3-METHYLENE CHROMANONES, ANTIMICROBIAL COMPOSITION CONTAINING SAME AND METHOD OF INHIBITING THE GROWTH OF MICROORGANISMS MILES LABORATORIES, INC. (US) 1982-06-09 EP disclosed
EP-0025161-A1 3-Methylene flavanones and 3-methylene chromanones, antimicrobial composition containing same and method of inhibiting the growth of microorganisms MILES LABORATORIES, INC. (US) 1981-03-18 EP disclosed
US-4241069-A MICROBIOCIDES MILES LABORATORIES, INC. (US) 1980-12-23 US disclosed