SCHEMBL25870700

SCHEMBL25870700

Cc1ccccc1N(c1ccc(C=C2C(=O)N(C)C(=S)N(C)C2=O)[se]1)c1c(C)ccc2ccccc12

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
ALDH1A1 P00352 6/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 3/20 0.31
CYP1A2 P05177 2/20 0.31
CYP2C9 P11712 2/20 0.31
CYP2C19 P33261 2/20 0.31
NPC1 O15118 2/20 0.31
POLB P06746 2/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
THRB P10828 1/20 0.31
HTT P42858 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
CRHBP P24387 1/20 0.30
CRHR2 Q13324 1/20 0.30
MAPK1 P28482 2/20 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
SCHEMBL25870684 0.89 KMT2A (0.34) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL25870709 0.87 MAPT (0.38) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL25870691 0.83 MAPT (0.35) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL18863392 0.80 MAPT (0.33) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL25870682 0.80 NOX4 (0.32) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL21076038 0.80 MAPT (0.34) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL25870726 0.78 LMNA (0.34) MAPTKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL25870681 0.77 MAPT (0.33) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL25870705 0.77 MAPT (0.32) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL25870683 0.76 MAPT (0.32) MAPTKMT2AMEN1ALDH1A1SMN1; 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