SCHEMBL2045530

SCHEMBL2045530

c1ccc(CO/N=C2/CCCC(=N\OCc3ccccc3)/C2=N\OCc2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.44
NPC1 O15118 1/20 0.44
L3MBTL1 Q9Y468 3/20 0.43
USP8 P40818 2/20 0.41
TSHR P16473 1/20 0.39
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
KMT2A Q03164 1/20 0.38
PKM P14618 1/20 0.38
TUBB4A P04350 1/20 0.38
TUBB P07437 1/20 0.38
TUBA3C P0DPH7 1/20 0.38
TUBA1B P68363 1/20 0.38
TUBA4A P68366 1/20 0.38
TUBB4B P68371 1/20 0.38
TUBB3 Q13509 1/20 0.38
TUBB2A Q13885 1/20 0.38
TUBB8 Q3ZCM7 1/20 0.38
TUBA3E Q6PEY2 1/20 0.38
TUBA1A Q71U36 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
SCHEMBL2045531 1.00 RAB9A (0.44) RAB9ANPC1L3MBTL1USP8TSHR
SCHEMBL9898776 0.89 MAPT (0.44) RAB9ANPC1L3MBTL1USP8TSHR
SCHEMBL9898777 0.89 MAPT (0.44) RAB9ANPC1L3MBTL1USP8TSHR
SCHEMBL2050061 0.87 RAB9A (0.47) RAB9ANPC1L3MBTL1USP8TSHR
SCHEMBL2050063 0.87 RAB9A (0.47) RAB9ANPC1L3MBTL1USP8TSHR
SCHEMBL14277940 0.80 L3MBTL1 (0.60) RAB9ANPC1L3MBTL1MEN1ALDH1A1
SCHEMBL9898654 0.80 MAOA (0.46) RAB9ANPC1L3MBTL1TSHRMEN1
SCHEMBL9898651 0.80 MAOA (0.46) RAB9ANPC1L3MBTL1TSHRMEN1
SCHEMBL9898108 0.79 MAPT (0.53) RAB9ANPC1L3MBTL1TSHRMEN1
SCHEMBL9898109 0.79 MAPT (0.53) RAB9ANPC1L3MBTL1TSHRMEN1

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-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
US-20110152449-A1 POLYMERS FUNCTIONALIZED WITH POLYOXIME COMPOUNDS AND METHODS FOR THEIR MANUFACTURE BRIDGESTONE CORPORATION (JP) 2011-06-23 US disclosed