SCHEMBL8774756

SCHEMBL8774756

CC[C@H]1CC[C@H](C(=O)Oc2cc(F)c(F)nc2F)CC1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.37
MEN1 O00255 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
CA2 P00918 1/20 0.35
HPGD P15428 4/20 0.35
POLB P06746 1/20 0.33
GRK6 P43250 1/20 0.33
GRM1 Q13255 1/20 0.33
CYP19A1 P11511 1/20 0.33
ALDH1A1 P00352 1/20 0.32
TRPV3 Q8NET8 1/20 0.32
NPC1 O15118 1/20 0.32

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
SCHEMBL8774765 1.00 L3MBTL1 (0.37) L3MBTL1MEN1RAB9AKMT2ACA2
SCHEMBL8774609 0.96 L3MBTL1 (0.35) L3MBTL1MEN1RAB9AKMT2ACA2
SCHEMBL8774597 0.96 L3MBTL1 (0.35) L3MBTL1MEN1RAB9AKMT2ACA2
SCHEMBL8774603 0.96 L3MBTL1 (0.35) L3MBTL1MEN1RAB9AKMT2ACA2
SCHEMBL8774033 0.90 KMT2A (0.35) L3MBTL1MEN1RAB9AKMT2ACA2
SCHEMBL8774026 0.90 KMT2A (0.35) L3MBTL1MEN1RAB9AKMT2ACA2
SCHEMBL8774310 0.89 HPGD (0.35) L3MBTL1MEN1RAB9AKMT2ACA2
SCHEMBL8774305 0.89 HPGD (0.35) L3MBTL1MEN1RAB9AKMT2ACA2
SCHEMBL8774649 0.88 MAPT (0.39) L3MBTL1MEN1RAB9AKMT2ACA2
SCHEMBL8774658 0.88 MAPT (0.39) L3MBTL1MEN1RAB9AKMT2ACA2

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
EP-0519370-B1 Heterocyclic derivatives MERCK PATENT GMBH (DE) 1997-11-05 EP disclosed
EP-0519370-A2 Heterocyclic derivatives MERCK PATENT GmbH (DE) 1992-12-23 EP disclosed