SCHEMBL28295750

SCHEMBL28295750

CCCCCCOc1c(CC)cccc1C[SiH2]c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.39
THRA P10827 3/20 0.38
THRB P10828 3/20 0.38
PLA2G4B P0C869 2/20 0.38
TSHR P16473 3/20 0.37
LMNA P02545 2/20 0.37
ALDH1A1 P00352 1/20 0.37
LTB4R Q15722 1/20 0.37
LTB4R2 Q9NPC1 1/20 0.37
MEN1 O00255 1/20 0.37
NR1I2 O75469 1/20 0.37
CHRM2 P08172 1/20 0.37
CYP3A4 P08684 1/20 0.37
ADRA2A P08913 1/20 0.37
MAPT P10636 1/20 0.37
OPRK1 P41145 1/20 0.37
HTR2B P41595 1/20 0.37
SLC6A3 Q01959 1/20 0.37
KMT2A Q03164 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37

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
SCHEMBL28295755 0.82 TSHR (0.40) PLA2G4BTSHRLMNAALDH1A1MEN1
SCHEMBL28293910 0.81 TSHR (0.39) THRATHRBPLA2G4BTSHRLMNA
SCHEMBL28293904 0.80 TSHR (0.38) PLA2G4BTSHRLMNAALDH1A1MEN1
SCHEMBL28293899 0.78 THRA (0.36) THRATHRBPLA2G4BTSHRLMNA
SCHEMBL28293909 0.76 TSHR (0.41) LTA4HPLA2G4BTSHRLMNAALDH1A1
SCHEMBL2712841 0.74 TSHR (0.45) LTA4HTHRATHRBTSHRLMNA
SCHEMBL15176184 0.74 TSHR (0.40) THRATHRBTSHRLMNAALDH1A1
SCHEMBL1419945 0.73 BID (0.49) TSHRALDH1A1MEN1MAPTKMT2A
SCHEMBL11330301 0.72 PTPN11 (0.52) PLA2G4BTSHRLMNAALDH1A1MEN1
SCHEMBL342807 0.72 PTPN11 (0.52) PLA2G4BTSHRLMNAALDH1A1MEN1

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-109790190-A Curing agent for silicone rubber material 硝基化学阿绍有限公司 2019-05-21 CN claimed
CN-109790190-A Curing agent for silicone rubber material 硝基化学阿绍有限公司 2019-05-21 CN disclosed