SCHEMBL9567802

SCHEMBL9567802

CC(C)(C)c1cc(-n2nc3ccccc3n2)c(O)cc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.55
RAB9A P51151 3/20 0.55
LMNA P02545 3/20 0.55
ALDH1A1 P00352 5/20 0.44
ALOX15 P16050 4/20 0.44
KDM4E B2RXH2 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
MAPT P10636 2/20 0.44
CYP1A2 P05177 1/20 0.44
ATP2A2 P16615 1/20 0.44
ATP2A3 Q93084 1/20 0.44
TSHR P16473 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
POLB P06746 2/20 0.40
TP53 P04637 3/20 0.38
HTT P42858 2/20 0.38
NR1I2 O75469 1/20 0.38
CYP2C9 P11712 1/20 0.38
MIF P14174 1/20 0.38
TYR P14679 1/20 0.38

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
SCHEMBL11472444 0.92 NPC1 (0.57) NPC1RAB9ALMNAALDH1A1ALOX15
SCHEMBL26924219 0.81 RAB9A (0.62) NPC1RAB9ALMNAALDH1A1ALOX15
SCHEMBL29602207 0.81 RAB9A (0.62) NPC1RAB9ALMNAALDH1A1ALOX15
SCHEMBL3263879 0.80 NPC1 (0.51) NPC1RAB9ALMNAALDH1A1KDM4E
SCHEMBL5814259 0.77 ALDH1A1 (0.50) NPC1RAB9ALMNAALDH1A1ALOX15
SCHEMBL11306262 0.77 NPC1 (0.51) NPC1RAB9ALMNAALDH1A1ALOX15
SCHEMBL78159 0.77 NPC1 (0.64) NPC1RAB9ALMNAALDH1A1ALOX15
SCHEMBL29354646 0.77 NPC1 (0.64) NPC1RAB9ALMNAALDH1A1ALOX15
SCHEMBL7869116 0.76 NPC1 (0.50) NPC1RAB9ALMNAALDH1A1ALOX15
SCHEMBL14462704 0.76 RAB9A (0.67) NPC1RAB9ALMNAALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0570992-A1 Powder coatings NIPPON PAINT CO., LTD. (JP) 1993-11-24 EP disclosed
US-5034432-A Thermosetting or thermoplastic resins for powder coatings NIPPON PAINT CO., LTD. (JP) 1991-07-23 US disclosed
US-4271307-A Bichromophoric benzotriazole-benzoxazole ultraviolet stabilizers and their use in organic compositions EASTMAN KODAK COMPANY (US) 1981-06-02 US disclosed
US-4076687-A Bichromophoric benzotriazole-benzoxazole ultraviolet stabilizers and their use in organic compositions EASTMAN KODAK COMPANY (US) 1978-02-28 US disclosed