SCHEMBL7592852

SCHEMBL7592852

CC(C)(C)CC(C)(C)c1ccc(O)c(-c2cc(C(C)(C)CC(C)(C)C)cc(-n3nc4ccccc4n3)c2O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
LMNA P02545 2/20 0.42
CYP3A4 P08684 3/20 0.38
HIF1A Q16665 2/20 0.38
CYP2D6 P10635 1/20 0.38
POLB P06746 1/20 0.36
SHBG P04278 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36
ESR1 P03372 1/20 0.36
TP53 P04637 1/20 0.36
PGR P06401 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
AR P10275 1/20 0.36
MAPT P10636 1/20 0.36
DRD1 P21728 1/20 0.36
PTGS1 P23219 1/20 0.36
SLC6A2 P23975 1/20 0.36

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
SCHEMBL7570384 0.93 NPC1 (0.45) NPC1RAB9ALMNACYP3A4HIF1A
SCHEMBL23636595 0.89 NPC1 (0.42) NPC1RAB9ALMNACYP3A4HIF1A
Octrizole SCHEMBL29349945 0.86 NPC1 (0.56) NPC1RAB9ALMNACYP3A4HIF1A
Octrizole SCHEMBL15508 0.86 NPC1 (0.56) NPC1RAB9ALMNACYP3A4HIF1A
Octrizole SCHEMBL28983126 0.86 NPC1 (0.56) NPC1RAB9ALMNACYP3A4HIF1A
SCHEMBL28904542 0.86 NPC1 (0.42) NPC1RAB9ALMNACYP3A4HIF1A
SCHEMBL18375140 0.85 NPC1 (0.45) NPC1RAB9ALMNACYP3A4HIF1A
Octrizole SCHEMBL30315837 0.85 NPC1 (0.55) NPC1RAB9ALMNACYP3A4HIF1A
SCHEMBL7592856 0.84 CNR1 (0.47) NPC1RAB9ALMNA
SCHEMBL9006429 0.83 NPC1 (0.41) NPC1RAB9ALMNACYP3A4HIF1A

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 5 patents. 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 claimed
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
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