SCHEMBL5490908

SCHEMBL5490908

c1c[nH]c(C(=C(c2ccc[nH]2)c2ccc[nH]2)c2ccc[nH]2)c1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.46
DAO P14920 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
CYP1A2 P05177 3/20 0.39
ATM Q13315 1/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CYP2D6 P10635 3/20 0.39
CYP1A1 P04798 1/20 0.39

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
SCHEMBL29441331 0.82 RAB9A (0.49) TSHRCYP1A2RAB9ASMN1; SMN2CYP2D6
SCHEMBL25398346 0.82 TSHR (0.39) TSHRDAOCYP1A2ATMMEN1
SCHEMBL5640920 0.79
SCHEMBL6820045 0.77 CYP1A2 (0.46) TSHRDAOHDAC8HDAC6CYP1A2
SCHEMBL5056943 0.77 CYP1A2 (0.46) TSHRCYP1A2NPC1RAB9ASMN1; SMN2
SCHEMBL5639786 0.77
SCHEMBL5320628 0.77 TSHR (0.54) TSHRCYP1A2ATMMEN1NPC1
SCHEMBL13656487 0.77 TSHR (0.43) TSHRDAOHDAC8HDAC6CYP1A2
SCHEMBL5067712 0.77 TSHR (0.43) TSHRDAOHDAC8HDAC6CYP1A2
SCHEMBL4263883 0.77

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-20070079722-A1 Chemiluminescent paint projectiles and method and preparation THE SEPRON COMPANY, L.C. 2007-04-12 US disclosed
WO-2005040288-A2 CHEMILUMINESCENT PAINT PROJECTILES AND METHOD OF PREPARATION THE SEPRON COMPANY, L.C. (US) 2005-05-06 WO disclosed