SCHEMBL2050802

SCHEMBL2050802

CC(CCC(C)=NOCc1ccccc1)=NOCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
ALDH1A1 P00352 2/20 0.47
TSHR P16473 2/20 0.43
MAPT P10636 2/20 0.43
LMNA P02545 3/20 0.42
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
PPARG P37231 2/20 0.41
S1PR1 P21453 1/20 0.41
PPARA Q07869 1/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
PTGIR P43119 1/20 0.40
IDO1 P14902 1/20 0.40
MAOB P27338 1/20 0.40

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
SCHEMBL2050800 1.00 NPC1 (0.47) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL9898635 0.91 ALDH1A1 (0.50) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL9898637 0.91 ALDH1A1 (0.50) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL28545178 0.91 NPC1 (0.44) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL2046768 0.88 PPARA (0.48) NPC1RAB9ASMN1; SMN2L3MBTL1LMNA
SCHEMBL2046767 0.88 PPARA (0.48) NPC1RAB9ASMN1; SMN2L3MBTL1LMNA
SCHEMBL2042655 0.88 NPC1 (0.47) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL2042653 0.88 NPC1 (0.47) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL9898562 0.87 NR4A2 (0.47) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL9898564 0.87 NR4A2 (0.47) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338544-B2 Polymers functionalized with polyoxime compounds and methods for their manufacture BRIDGESTONE CORPORATION (JP) 2012-12-25 US claimed
EP-2516475-A1 POLYMERS FUNCTIONALIZED WITH POLYOXIME COMPOUNDS AND METHODS FOR THEIR MANUFACTURE Bridgestone Corporation (JP) 2012-10-31 EP claimed
US-20110152449-A1 POLYMERS FUNCTIONALIZED WITH POLYOXIME COMPOUNDS AND METHODS FOR THEIR MANUFACTURE BRIDGESTONE CORPORATION (JP) 2011-06-23 US claimed
US-8338544-B2 Polymers functionalized with polyoxime compounds and methods for their manufacture BRIDGESTONE CORPORATION (JP) 2012-12-25 US disclosed
EP-2516475-A1 POLYMERS FUNCTIONALIZED WITH POLYOXIME COMPOUNDS AND METHODS FOR THEIR MANUFACTURE Bridgestone Corporation (JP) 2012-10-31 EP disclosed
US-20110152449-A1 POLYMERS FUNCTIONALIZED WITH POLYOXIME COMPOUNDS AND METHODS FOR THEIR MANUFACTURE BRIDGESTONE CORPORATION (JP) 2011-06-23 US disclosed