SCHEMBL25870729

SCHEMBL25870729

CN1C(=O)C(=Cc2ccc(N(c3ccc(F)cc3)c3ccc(F)c4ccccc34)[se]2)C(=O)N(C)C1=S

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HTT P42858 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL25870724 0.95 MAPT (0.32) LMNAMAPTMEN1RAB9AKMT2A
SCHEMBL25870726 0.88 LMNA (0.34) LMNAMAPTMEN1RAB9AKMT2A
SCHEMBL25870706 0.85 MAPT (0.32) LMNAMAPTMEN1RAB9AKMT2A
SCHEMBL25870735 0.85 LMNA (0.39) LMNAMAPTMEN1RAB9AKMT2A
SCHEMBL25870740 0.85 MAPT (0.39) LMNAMAPTMEN1RAB9AKMT2A
SCHEMBL25870717 0.85 MAPT (0.32) LMNAMAPTMEN1RAB9AKMT2A
SCHEMBL25870683 0.84 MAPT (0.32) MAPTMEN1RAB9AKMT2ASMN1; SMN2
SCHEMBL25870681 0.84 MAPT (0.33) MAPTMEN1RAB9AKMT2ASMN1; SMN2
SCHEMBL25870702 0.83 MAPT (0.32) MAPTMEN1RAB9AKMT2ASMN1; SMN2
SCHEMBL25870718 0.83 NOX4 (0.31) MAPTMEN1RAB9AKMT2ASMN1; 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
US-11711930-B2 2023-07-25 US disclosed