SCHEMBL25870717

SCHEMBL25870717

Cc1ccc(N(c2ccc(Cl)cc2)c2ccc(C=C3C(=O)N(C)C(=S)N(C)C3=O)[se]2)c2ccccc12

nearest known ligand 0.32

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.32
HPGD P15428 4/20 0.32
KMT2A Q03164 4/20 0.32
ALDH1A1 P00352 3/20 0.32
LMNA P02545 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
APEX1 P27695 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.31
MEN1 O00255 2/20 0.31
MDM2 Q00987 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
RAB9A P51151 1/20 0.31
CISD1 Q9NZ45 2/20 0.31
MAOB P27338 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HTT P42858 1/20 0.30
TAAR1 Q96RJ0 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 0.92 MAPT (0.32) MAPTHPGDKMT2AALDH1A1SMN1; SMN2
SCHEMBL25870681 0.92 MAPT (0.33) MAPTHPGDKMT2AALDH1A1SMN1; SMN2
SCHEMBL25870706 0.91 MAPT (0.32) MAPTHPGDKMT2AALDH1A1LMNA
SCHEMBL25870705 0.88 MAPT (0.32) MAPTHPGDKMT2AALDH1A1LMNA
SCHEMBL25870718 0.87 NOX4 (0.31) MAPTKMT2ASMN1; SMN2MEN1RAB9A
SCHEMBL25870702 0.85 MAPT (0.32) MAPTHPGDKMT2AALDH1A1SMN1; SMN2
SCHEMBL25870832 0.85 KDM4E (0.34) MAPTHPGDKMT2AALDH1A1TDP1
SCHEMBL25870710 0.85 MAPT (0.37) MAPTHPGDKMT2AALDH1A1LMNA
SCHEMBL18863387 0.85 CISD1 (0.39) MAPTHPGDKMT2AALDH1A1LMNA
SCHEMBL25870729 0.85 LMNA (0.34) MAPTKMT2ALMNANPSR1SMN1; 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