SCHEMBL7574172

SCHEMBL7574172

CC(C)(C)c1cc(-c2cc(C(C)(C)C)cc(-n3nc4ccccc4n3)c2O)c(O)c(-n2nc3ccccc3n2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.50
RAB9A P51151 5/20 0.50
LMNA P02545 1/20 0.46
POLB P06746 2/20 0.45
ALDH1A1 P00352 3/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KDM4E B2RXH2 4/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
HPGD P15428 2/20 0.35
HSP90AA1 P07900 1/20 0.34
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
PLA2G1B P04054 1/20 0.33
NFKB1 P19838 1/20 0.33
CASP3 P42574 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 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
SCHEMBL23636595 0.89 NPC1 (0.42) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL30893054 0.88 NPC1 (0.50) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL108807 0.88 NPC1 (0.54) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL9567799 0.88 NPC1 (0.50) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL29813370 0.88 NPC1 (0.54) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL7701678 0.87 NPC1 (0.47) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL29708 0.86 NPC1 (0.49) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL29350736 0.86 NPC1 (0.49) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL9408718 0.85 NPC1 (0.48) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL6929698 0.85 NPC1 (0.48) NPC1RAB9ALMNAPOLBALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1238003-A1 MONO- AND BIS- BENZOTRIAZOLYLDIHYDROXYBIARYL UV ABSORBERS CYTEC TECHNOLOGY CORP. (US) 2002-09-11 EP disclosed
US-6344505-B1 Mono- and bis-benzotriazolyldihydroxybiaryl UV absorbers CYTEC INDUSTRIES INC. 2002-02-05 US disclosed
WO-2001034694-A1 MONO- AND BIS- BENZOTRIAZOLYLDIHYDROXYBIARYL UV ABSORBERS CYTEC TECHNOLOGY CORP. (US) 2001-05-17 WO disclosed