SCHEMBL8977933

SCHEMBL8977933

C=CCOP(O)Oc1ccc(C)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
ACHE P22303 1/20 0.33
SMN1; SMN2 Q16637 5/20 0.33
NPC1 O15118 4/20 0.33
RAB9A P51151 4/20 0.33
MAPT P10636 2/20 0.33
POLB P06746 1/20 0.33
WDR5 P61964 1/20 0.33
TGM2 P21980 1/20 0.33
LMNA P02545 3/20 0.32
ALDH1A1 P00352 3/20 0.32
USP2 O75604 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MCOLN3 Q8TDD5 1/20 0.32
TP53 P04637 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
RELA Q04206 1/20 0.32
CYP2D6 P10635 1/20 0.31
TSHR P16473 3/20 0.31

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
SCHEMBL466325 0.82 CYP3A4 (0.38) HPGDHTTSMN1; SMN2NPC1RAB9A
SCHEMBL5179757 0.77 ESR1 (0.44) HPGDHTTSMN1; SMN2NPC1RAB9A
SCHEMBL258227 0.77 ACHE (0.48) HPGDHTTACHESMN1; SMN2NPC1
SCHEMBL28366047 0.77 ACHE (0.37) HPGDHTTACHESMN1; SMN2NPC1
Propylene Glycol SCHEMBL9091609 0.75 LMNA (0.39) LMNAALDH1A1CYP2D6KMT2AMEN1
SCHEMBL11311298 0.75 ACHE (0.46) HPGDHTTACHESMN1; SMN2NPC1
SCHEMBL7159961 0.74 MITF (0.38) ACHESMN1; SMN2LMNAALDH1A1L3MBTL1
SCHEMBL472078 0.71 CA12 (0.53) HPGDHTTACHESMN1; SMN2NPC1
SCHEMBL28004434 0.71 ACHE (0.48) HPGDACHESMN1; SMN2NPC1RAB9A
SCHEMBL3874496 0.70 SMN1; SMN2 (0.44) HPGDHTTACHESMN1; SMN2NPC1

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-5567560-A Triphenylamine derivative charge-transporting material containing electrophotographic photoreceptor TAKASAGO INTERNATIONAL CORPORATION (JP) 1996-10-22 US disclosed