SCHEMBL7260303

SCHEMBL7260303

CCCCSc1ccc(C)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.47
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 3/20 0.41
MAPT P10636 2/20 0.41
THRB P10828 4/20 0.40
XDH P47989 1/20 0.39
LMNA P02545 2/20 0.39
GFER P55789 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
TLR8 Q9NR97 1/20 0.38
SLC2A1 P11166 1/20 0.38
GAA P10253 2/20 0.38
HPGD P15428 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
SCHEMBL5170851 0.90 KMT2A (0.45) ARMEN1KMT2ANPC1RAB9A
SCHEMBL22755735 0.83 AR (0.47) ARMAOAMAOBNPC1RAB9A
SCHEMBL11856104 0.83 AR (0.51) ARMAOAMAOBKMT2ANPC1
SCHEMBL6534989 0.83 ESR1 (0.50) ARMAOAMAOBTHRB
SCHEMBL22755715 0.82 AR (0.43) ARMAOAMAOBNPC1RAB9A
SCHEMBL8638831 0.81 AR (0.51) ARMAOAMAOBNPC1RAB9A
SCHEMBL9478191 0.81 NPC1 (0.43) ARMEN1KMT2ANPC1RAB9A
SCHEMBL14154715 0.81 MAPT (0.39) ARMAOAMAOBMEN1KMT2A
SCHEMBL5887468 0.80 MAOA (0.62) ARMAOAMAOBNPC1RAB9A
SCHEMBL424971 0.77 HPGD (0.56) ARMAOAMAOBMEN1KMT2A

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
US-6652930-B2 Comprises mixture of compounds such as 1,2-bis(2-hydroxyethyl thio)ethane and homo/copolymers of diallylamine compounds such as polydiallylamine hydrochloride; phthalocyanine dye adds to stability; discoloration inhibition extends shelf-life OJI PAPER CO., LTD. (JP) 2003-11-25 US disclosed
US-20020071941-A1 Sheet for ink jet-recording OJI PAPER CO., LTD. (JP) 2002-06-13 US disclosed