SCHEMBL28569606

SCHEMBL28569606

NC(=O)CCCCCCCCCCCCC(N)=O.OCCN(CCO)OB(O)O

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
FAAH O00519 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
SOAT1 P35610 1/20 0.32
KMT2A Q03164 1/20 0.32
GPR84 Q9NQS5 1/20 0.30
FFAR1 O14842 1/20 0.30
FFAR4 Q5NUL3 1/20 0.30

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
SCHEMBL27826162 0.79 MAPT (0.32)
Ammonia Solution, Strong SCHEMBL29242547 0.77 MAPT (0.30)
SCHEMBL2149157 0.68 LMNA (0.38) MEN1FAAHTP53CYP1A2CYP3A4
SCHEMBL5575807 0.67 GPR84 (0.60) MEN1FAAHTP53CYP1A2CYP3A4
SCHEMBL5575804 0.67 GPR84 (0.60) MEN1FAAHTP53CYP1A2CYP3A4
SCHEMBL8411317 0.67 GPR84 (0.60) MEN1FAAHTP53CYP1A2CYP3A4
SCHEMBL1479946 0.67 GPR84 (0.60) MEN1FAAHTP53CYP1A2CYP3A4
SCHEMBL2011125 0.67 GPR84 (0.60) MEN1FAAHTP53CYP1A2CYP3A4
SCHEMBL7554526 0.67 GPR84 (0.60) MEN1FAAHTP53CYP1A2CYP3A4
SCHEMBL2839590 0.67 GPR84 (0.60) MEN1FAAHTP53CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112873526-A Cutting process of aerated concrete plate 安徽省高迪循环经济产业园股份有限公司 2021-06-01 CN claimed
CN-112873526-A Cutting process of aerated concrete plate 安徽省高迪循环经济产业园股份有限公司 2021-06-01 CN disclosed