SCHEMBL25870688

SCHEMBL25870688

Cc1ccc(N(c2ccccc2)c2ccc(C=C3C(=O)N(C)C(=S)N(C)C3=O)[se]2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.36
MEN1 O00255 8/20 0.36
KMT2A Q03164 8/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
RAB9A P51151 2/20 0.36
NOX4 Q9NPH5 5/20 0.36
NOX1 Q9Y5S8 3/20 0.36
CYBB P04839 2/20 0.35
HTT P42858 2/20 0.35
TAAR1 Q96RJ0 1/20 0.35
ALDH1A1 P00352 5/20 0.34
HPGD P15428 2/20 0.34
MAPK1 P28482 1/20 0.34
EP300 Q09472 1/20 0.34
CYP1A2 P05177 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
POLB P06746 2/20 0.33
APP P05067 1/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL18863386 0.95 MAPT (0.39) MAPTMEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL18863393 0.94 MAPT (0.40) MAPTMEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL25870735 0.91 LMNA (0.39) MAPTMEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL25870710 0.90 MAPT (0.37) MAPTMEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL25870721 0.90 CISD1 (0.36) MAPTMEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL25870715 0.87 MAPT (0.34) MAPTMEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL25870691 0.86 MAPT (0.35) MAPTMEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL25870740 0.85 MAPT (0.39) MAPTMEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL25870682 0.85 NOX4 (0.32) MAPTMEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL25870683 0.85 MAPT (0.32) MAPTMEN1KMT2ASMN1; SMN2RAB9A

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