SCHEMBL6516967

SCHEMBL6516967

CC(C)(C)c1cc(CCCCO)cc(-n2nc3ccccc3n2)c1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
LMNA P02545 3/20 0.38
ALDH1A1 P00352 6/20 0.38
GAA P10253 4/20 0.38
POLB P06746 3/20 0.38
HPGD P15428 3/20 0.38
TSHR P16473 2/20 0.38
THRB P10828 1/20 0.38
KDM4E B2RXH2 4/20 0.36
MAPK1 P28482 3/20 0.36
ALOX15 P16050 2/20 0.36
HSD17B10 Q99714 1/20 0.36
GSR P00390 2/20 0.35
MAPT P10636 2/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
MAOA P21397 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
SCHEMBL105358 0.96 NPC1 (0.42) NPC1RAB9ALMNAALDH1A1GAA
SCHEMBL30240935 0.91 NPC1 (0.44) NPC1RAB9ALMNAALDH1A1GAA
SCHEMBL75075 0.91 NPC1 (0.44) NPC1RAB9ALMNAALDH1A1GAA
SCHEMBL30485788 0.89 NPC1 (0.40) NPC1RAB9ALMNAALDH1A1GAA
SCHEMBL2464472 0.89 NPC1 (0.40) NPC1RAB9ALMNAALDH1A1GAA
SCHEMBL8773778 0.89 NPC1 (0.40) NPC1RAB9ALMNAALDH1A1GAA
SCHEMBL2955109 0.89 NPC1 (0.42) NPC1RAB9ALMNAALDH1A1GAA
1,6-Hexanediol SCHEMBL4254054 0.88 MAOB (0.41) NPC1RAB9ALMNAALDH1A1GAA
SCHEMBL9323589 0.88 NPC1 (0.44) NPC1RAB9ALMNAALDH1A1GAA
SCHEMBL14596692 0.88 NPC1 (0.38) NPC1RAB9ALMNAALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0834304-B1 Use of liposomogenic UV absorbers to protect hair CIBA SC HOLDING AG (CH) 2005-01-26 EP disclosed
EP-0815071-B1 LIPOSOMOGENIC UV ABSORBERS CIBA SC HOLDING AG (CH) 2001-04-11 EP disclosed
US-6017556-A PROTECTING HUMAN HAIR FROM THE DAMAGING EFFECT OF ULTRAVIOLET RADIATION BY TREATING HUMAN HAIR WITH A LIPOSOMOGENIC ULTRAVIOLET RADIATION ABSORBER CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-01-25 US disclosed
US-6015575-A TRIAZINE, BENZOTRIAZOLE, BENZOPHENONE AND AMINOBENZOIC ACID DERIVATIVES AS RADIATION ABSORBERS CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-01-18 US disclosed
EP-0834304-A2 Liposomogenic UV absorbers Ciba SC Holding AG (CH) 1998-04-08 EP disclosed
EP-0815071-A1 LIPOSOMOGENIC UV ABSORBERS Ciba SC Holding AG (CH) 1998-01-07 EP disclosed
WO-1996029302-A1 LIPOSOMOGENIC UV ABSORBERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1996-09-26 WO disclosed