SCHEMBL28410199

SCHEMBL28410199

CCC(C)(C)C1=CC=CC(N=Nc2cccc(C(C)(C)CC)c2)C1(O)[N+](=O)[O-]

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL28408350 0.76 MEN1 (0.31) MEN1NPC1RAB9AKMT2A
SCHEMBL28408931 0.76 MEN1 (0.31) MEN1NPC1RAB9AKMT2A
SCHEMBL27970251 0.72
SCHEMBL28548694 0.71 HDAC4 (0.30)
SCHEMBL28357160 0.68 MAPT (0.38) MEN1NPC1RAB9AKMT2A
SCHEMBL28725270 0.67 MEN1 (0.32) MEN1NPC1RAB9AKMT2A
SCHEMBL28360923 0.64 NPC1 (0.44) MEN1NPC1RAB9AKMT2A
SCHEMBL28360926 0.64 NPC1 (0.44) MEN1NPC1RAB9AKMT2A
SCHEMBL28410189 0.63 NPC1 (0.33) MEN1NPC1RAB9AKMT2A
SCHEMBL28548316 0.63 HDAC4 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110092763-B Preparation method of ultraviolet absorbent UV-328 襄阳金达成精细化工有限公司 2020-07-07 CN claimed
CN-110092763-B Preparation method of ultraviolet absorbent UV-328 襄阳金达成精细化工有限公司 2020-07-07 CN disclosed
CN-108148009-B Method for preparing benzotriazole ultraviolet absorbent by adopting catalytic hydrogen transfer method 天津利安隆新材料股份有限公司 2020-05-12 CN disclosed