SCHEMBL8892289

SCHEMBL8892289

CCOC=C(C(=O)c1ccc(CC)c(C)c1Cc1ccccc1)C(=O)C1CC1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 1/20 0.35
PDE3B Q13370 2/20 0.34
PDE3A Q14432 2/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 1/20 0.33
LTA4H P09960 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.32
SCN1A P35498 1/20 0.31
SCN2A Q99250 1/20 0.31
SCN3A Q9NY46 1/20 0.31
PKM P14618 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TP53 P04637 1/20 0.31
FAAH O00519 1/20 0.31
CNR2 P34972 1/20 0.31
NR1H4 Q96RI1 1/20 0.30

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
SCHEMBL8892357 0.87 MAP2K1 (0.33) MAP2K1PDE3BPDE3AMEN1KMT2A
SCHEMBL8892368 0.87 MAP2K1 (0.33) MAP2K1PDE3BPDE3AMEN1KMT2A
SCHEMBL8892286 0.86 SMN1; SMN2 (0.34) MAP2K1PDE3BPDE3AMEN1KMT2A
SCHEMBL8817690 0.77 CCR6 (0.41) MEN1KMT2A
SCHEMBL8817699 0.77 CCR6 (0.41) MEN1KMT2A
SCHEMBL8683752 0.70 KDM4E (0.40) CNR2
SCHEMBL8491623 0.70 KDM4E (0.40) CNR2
SCHEMBL8488251 0.70 SLC6A4 (0.35) MEN1KMT2ANPSR1SMN1; SMN2TP53
SCHEMBL8488252 0.70 SLC6A4 (0.35) MEN1KMT2ANPSR1SMN1; SMN2TP53
SCHEMBL8491834 0.69 KMT2A (0.39) MEN1KMT2APOLBSMN1; SMN2

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
WO-1997028136-A1 BENZOYLISOXAZOLES AND 2-CYANO-1,3-DIONE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1997-08-07 WO disclosed