SCHEMBL30798372

SCHEMBL30798372

COc1ccc(F)c(C(=O)NC(C)(C)CO)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.48
CNR2 P34972 2/20 0.48
KDM4E B2RXH2 3/20 0.44
MAPK1 P28482 1/20 0.44
CLK1 P49759 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
P2RX7 Q99572 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
PTGS2 P35354 1/20 0.41
TP53 P04637 2/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
MAPT P10636 1/20 0.41
ALOX15 P16050 1/20 0.41
ALOX12 P18054 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL24718226 1.00 CNR1 (0.48) CNR1CNR2KDM4EMAPK1CLK1
SCHEMBL30804746 0.88 KDM4E (0.43) KDM4EMAPK1CLK1NPC1RAB9A
SCHEMBL20812767 0.85 POLB (0.50) KDM4ECLK1NPC1RAB9AP2RX7
SCHEMBL11833701 0.83 HPGD (0.55) CNR1CNR2KDM4EMAPK1NPC1
SCHEMBL6419790 0.82 CNR2 (0.51) CNR1CNR2NPC1RAB9A
SCHEMBL6421030 0.81 ACVR1B (0.50) CNR1CNR2NPC1RAB9ASMN1; SMN2
SCHEMBL25213585 0.79 CA1 (0.54) KDM4EMAPK1CLK1NPC1RAB9A
SCHEMBL5777771 0.78 CNR1 (0.45) CNR1CNR2KDM4ENPC1RAB9A
SCHEMBL6415236 0.77 POLB (0.50) CNR1CNR2NPC1RAB9A
SCHEMBL24353844 0.77 POLB (0.44) CNR1CNR2NPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4323352-A1 MODULATORS OF BCL6 PROTEOLYSIS AND ASSOCIATED METHODS OF USE Arvinas Operations, Inc. (US) 2024-02-21 EP disclosed