SCHEMBL7703339

SCHEMBL7703339

Cc1cc(-c2cc(C)cc(-n3nc4ccccc4n3)c2O)c(O)c(-n2nc3ccccc3n2)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.71
RAB9A P51151 9/20 0.71
LMNA P02545 1/20 0.63
POLB P06746 2/20 0.62
SMN1; SMN2 Q16637 6/20 0.49
ALDH1A1 P00352 5/20 0.49
KDM4E B2RXH2 5/20 0.48
MAPT P10636 5/20 0.41
HPGD P15428 5/20 0.41
TDP1 Q9NUW8 2/20 0.41
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
IGF2BP2 Q9Y6M1 1/20 0.38
THRB P10828 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
TDO2 P48775 1/20 0.35
IDO2 Q6ZQW0 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL1275936 0.86 NPC1 (0.71) NPC1RAB9ALMNAPOLBSMN1; SMN2
SCHEMBL110113 0.86 NPC1 (0.71) NPC1RAB9ALMNAPOLBSMN1; SMN2
SCHEMBL29489567 0.86 NPC1 (0.71) NPC1RAB9ALMNAPOLBSMN1; SMN2
SCHEMBL18375849 0.83 NPC1 (0.68) NPC1RAB9ALMNAPOLBSMN1; SMN2
SCHEMBL10598824 0.83 NPC1 (1.00) NPC1RAB9ALMNAPOLBSMN1; SMN2
SCHEMBL9408736 0.83 NPC1 (0.68) NPC1RAB9ALMNAPOLBSMN1; SMN2
SCHEMBL105385 0.83 NPC1 (0.68) NPC1RAB9ALMNAPOLBSMN1; SMN2
SCHEMBL31267541 0.82 NPC1 (0.66) NPC1RAB9ALMNAPOLBSMN1; SMN2
SCHEMBL20365734 0.82 NPC1 (0.66) NPC1RAB9ALMNAPOLBSMN1; SMN2
SCHEMBL258759 0.82 NPC1 (0.66) NPC1RAB9ALMNAPOLBSMN1; SMN2

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-6344505-B1 Mono- and bis-benzotriazolyldihydroxybiaryl UV absorbers CYTEC INDUSTRIES INC. 2002-02-05 US disclosed