SCHEMBL5597840

SCHEMBL5597840

O=C1c2c(O)cc(O)cc2OC(c2ccccc2)C1(O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.54
MEN1 O00255 5/20 0.54
KMT2A Q03164 5/20 0.54
MAPT P10636 5/20 0.54
CYP1A2 P05177 4/20 0.54
HSD17B10 Q99714 4/20 0.54
CYP19A1 P11511 4/20 0.54
CYP1A1 P04798 3/20 0.54
CYP1B1 Q16678 3/20 0.54
CYP2C19 P33261 3/20 0.54
CYP2C9 P11712 2/20 0.54
CYP2D6 P10635 1/20 0.54
RECQL P46063 4/20 0.44
GAA P10253 3/20 0.44
POLB P06746 3/20 0.44
ALOX12 P18054 2/20 0.44
SOST Q9BQB4 2/20 0.44
KDM4E B2RXH2 2/20 0.44
ALOX15 P16050 2/20 0.44
MAPK1 P28482 2/20 0.44

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
SCHEMBL6068882 0.90 CYP3A4 (0.53) CYP3A4MEN1KMT2AMAPTCYP1A2
SCHEMBL15544677 0.85 RECQL (0.55) CYP3A4MEN1KMT2AMAPTCYP1A2
SCHEMBL31237635 0.85 RECQL (0.55) CYP3A4MEN1KMT2AMAPTCYP1A2
SCHEMBL28006751 0.84 RECQL (0.55) CYP3A4MEN1KMT2AMAPTCYP1A2
SCHEMBL5146606 0.83 POLB (0.60) CYP3A4MEN1KMT2AMAPTCYP1A2
SCHEMBL31238336 0.81 RECQL (0.56) CYP3A4MEN1KMT2AMAPTCYP1A2
SCHEMBL31651095 0.75 CYP3A4 (0.46) CYP3A4MEN1KMT2AMAPTCYP1A2
SCHEMBL30754201 0.74 CYP3A4 (0.51) CYP3A4MEN1KMT2AMAPTCYP1A2
SCHEMBL5313705 0.73 DNMT3B (0.57) CYP3A4MAPTHSD17B10CYP19A1RECQL
SCHEMBL27660441 0.73 XDH (0.47) CYP3A4MEN1KMT2AMAPTHSD17B10

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
WO-2024189607-A1 METHODS AND BIOAVAILABLE HIGHLY PERMEABLE COMPOUNDS FOR DISEASES TREATMENT DIDENKO KIRILL (MX) 2024-09-19 WO disclosed
EP-1738781-A2 Use of propolis for coating medical implants BIOTRONIK VI Patent AG (CH) 2007-01-03 EP disclosed