SCHEMBL31376705

SCHEMBL31376705

C#CCCCCCCCCCCOC(=O)CCCCCBr

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
HSD17B10 Q99714 1/20 0.48
DGKA P23743 1/20 0.43
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
FAAH O00519 1/20 0.37
DNM1 Q05193 1/20 0.37
GSTP1 P09211 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
HTR2C P28335 1/20 0.36
NAAA Q02083 1/20 0.35
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL29774909 1.00 MAPT (0.48) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL31376707 1.00 MAPT (0.48) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL31376703 1.00 MAPT (0.48) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL29119279 1.00 MAPT (0.48) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL29119268 1.00 MAPT (0.48) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL24588849 1.00 MAPT (0.48) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL29119159 0.92 MAPT (0.41) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL10011687 0.91 MAPT (0.52) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL24588740 0.87 MAPT (0.38) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL10010053 0.87 MAPT (0.47) MAPTCYP1A2CYP2D6CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119454649-A Preparation method of lipid nanoparticle and complex thereof 纳科药业科技(深圳)有限公司 2025-02-18 CN disclosed