SCHEMBL25870681

SCHEMBL25870681

Cc1ccc(N(c2ccccc2)c2ccc(C=C3C(=O)N(C)C(=S)N(C)C3=O)[se]2)c2ccccc12

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.33
KMT2A Q03164 7/20 0.33
MEN1 O00255 6/20 0.33
ALDH1A1 P00352 5/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 2/20 0.33
HTT P42858 2/20 0.32
TAAR1 Q96RJ0 1/20 0.32
POLB P06746 2/20 0.31
RECQL P46063 1/20 0.31
MAPK1 P28482 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
EP300 Q09472 1/20 0.31
CYP1A2 P05177 2/20 0.30
CYP2C9 P11712 2/20 0.30
CYP2C19 P33261 2/20 0.30
NPC1 O15118 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 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
SCHEMBL25870683 0.94 MAPT (0.32) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL25870717 0.92 MAPT (0.32) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL25870724 0.89 MAPT (0.32) MAPTKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL25870702 0.89 MAPT (0.32) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL25870691 0.87 MAPT (0.35) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL25870713 0.87 MEN1 (0.31) MAPTKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL18863392 0.87 MAPT (0.33) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL18863393 0.86 MAPT (0.40) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL25870718 0.84 NOX4 (0.31) MAPTKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL25870729 0.84 LMNA (0.34) MAPTKMT2AMEN1SMN1; 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