SCHEMBL28533683

SCHEMBL28533683

CC(c1ccc(Br)cc1)[SiH](c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 3/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAPK1 P28482 1/20 0.39
LMNA P02545 2/20 0.39
ALOX5 P09917 1/20 0.38
SLC6A2 P23975 3/20 0.38
SLC6A4 P31645 3/20 0.38
SLC6A3 Q01959 3/20 0.38
CHRM2 P08172 2/20 0.38
CHRM1 P11229 2/20 0.38
DRD1 P21728 2/20 0.38
HTR1A P08908 1/20 0.38
ADRA2A P08913 1/20 0.38
TBXA2R P21731 1/20 0.38
OPRM1 P35372 1/20 0.38
DRD3 P35462 1/20 0.38
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36

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
SCHEMBL28471422 0.79 ALDH1A1 (0.39) SMN1; SMN2ALDH1A1LMNAKMT2AMEN1
SCHEMBL28399566 0.79 ALDH1A1 (0.39) SMN1; SMN2ALDH1A1LMNAKMT2AMEN1
SCHEMBL28399569 0.79 ALDH1A1 (0.39) SMN1; SMN2ALDH1A1LMNAKMT2AMEN1
SCHEMBL28907496 0.79 IDO1 (0.46) ALDH1A1TDP1MAPK1KMT2AMEN1
SCHEMBL28405385 0.76 CA4 (0.48) ALDH1A1TDP1MAPK1SLC6A2SLC6A4
SCHEMBL28481733 0.76 CA4 (0.48) ALDH1A1TDP1MAPK1SLC6A2SLC6A4
SCHEMBL28479411 0.76 TP53 (0.48) SMN1; SMN2ALDH1A1TDP1MAPK1LMNA
SCHEMBL28405384 0.76 CA4 (0.48) ALDH1A1TDP1MAPK1SLC6A2SLC6A4
SCHEMBL28479410 0.76 TP53 (0.48) SMN1; SMN2ALDH1A1TDP1MAPK1LMNA
SCHEMBL13528594 0.73 HTR2A (0.39) HTR2ASMN1; SMN2ALDH1A1TDP1MAPK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112387313-B Tridentate phenanthroline manganese catalyst and application thereof in synthesis of organic silicon/boron compound 中山大学 2022-08-16 CN disclosed
CN-112387313-A Tridentate phenanthroline manganese catalyst and application thereof in synthesis of organic silicon/boron compound 中山大学 2021-02-23 CN disclosed