SCHEMBL25870715

SCHEMBL25870715

CN1C(=O)C(=Cc2ccc(N(c3ccccc3)c3ccc(C#N)cc3)[se]2)C(=O)N(C)C1=S

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.34
KMT2A Q03164 7/20 0.34
MEN1 O00255 6/20 0.34
RAB9A P51151 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NOX4 Q9NPH5 3/20 0.33
CYBB P04839 2/20 0.33
HTT P42858 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
NOX1 Q9Y5S8 1/20 0.32
EP300 Q09472 2/20 0.32
CREBBP Q92793 1/20 0.32
GABRA1 P14867 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
ALDH1A1 P00352 4/20 0.31
CYP1A2 P05177 2/20 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
SCHEMBL18863393 0.90 MAPT (0.40) MAPTKMT2AMEN1RAB9ASMN1; SMN2
SCHEMBL25870735 0.87 LMNA (0.39) MAPTKMT2AMEN1RAB9ASMN1; SMN2
SCHEMBL25870688 0.87 MAPT (0.36) MAPTKMT2AMEN1RAB9ASMN1; SMN2
SCHEMBL25870710 0.86 MAPT (0.37) MAPTKMT2AMEN1RAB9ASMN1; SMN2
SCHEMBL25870713 0.83 MEN1 (0.31) MAPTKMT2AMEN1RAB9ASMN1; SMN2
SCHEMBL18863386 0.82 MAPT (0.39) MAPTKMT2AMEN1RAB9ASMN1; SMN2
SCHEMBL25870740 0.82 MAPT (0.39) MAPTKMT2AMEN1RAB9ASMN1; SMN2
SCHEMBL25870678 0.81 MAPT (0.40) MAPTKMT2AMEN1SMN1; SMN2EP300
SCHEMBL18863387 0.81 CISD1 (0.39) MAPTKMT2AMEN1RAB9ASMN1; SMN2
SCHEMBL25870691 0.81 MAPT (0.35) MAPTKMT2AMEN1RAB9ASMN1; 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