SCHEMBL8669532

SCHEMBL8669532

CCCCCCCC[PH](CCCCCCCC)(CCCCCCCC)Cc1ccccc1C[PH](CCCC)(CCCC)CCCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.43
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36
CYSLTR2 Q9NS75 2/20 0.36
CYSLTR1 Q9Y271 2/20 0.36
KCNH2 Q12809 2/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
DNM1 Q05193 1/20 0.34
BID P55957 2/20 0.33
BCL2L1 Q07817 2/20 0.33
MCL1 Q07820 2/20 0.33
BAK1 Q16611 2/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
MEN1 O00255 1/20 0.33
TP53 P04637 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL8669305 0.92 LIPG (0.41) LIPGNR1H2NR1H3KCNH2ALDH1A1
SCHEMBL4840342 0.81 THRA (0.37) LIPGNR1H2NR1H3ALDH1A1THRA
SCHEMBL4835886 0.81 THRA (0.37) LIPGNR1H2NR1H3ALDH1A1THRA
SCHEMBL2346267 0.81 THRA (0.37) LIPGNR1H2NR1H3ALDH1A1THRA
SCHEMBL11128949 0.80 DNM1 (0.46) KCNH2DNM1MEN1TP53MAPK1
SCHEMBL3382982 0.80 DNM1 (0.46) KCNH2DNM1MEN1TP53MAPK1
SCHEMBL915232 0.79 ESR1 (0.41) LIPGALDH1A1THRATHRBTP53
Phosphine SCHEMBL27539974 0.78 DNM1 (0.44) KCNH2DNM1MEN1TP53MAPK1
Hydrochloric Acid SCHEMBL28908434 0.78 DNM1 (0.44) KCNH2DNM1MEN1TP53MAPK1
SCHEMBL8670612 0.78 LPL (0.41) LIPGKCNH2CYP1A2CYP2D6CYP2C19

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
EP-0630884-B1 Method and composition providing enhanced chemiluminescence from chemiluminescent compounds using dicationic surfactants LUMIGEN INC (US) 1998-12-23 EP claimed