SCHEMBL25201345

SCHEMBL25201345

CCCCC(CC)COOCCCCCOC(=O)OCCCCCOOCC(CC)CCCC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.51
TSHR P16473 3/20 0.51
ATM Q13315 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
ALDH1A1 P00352 5/20 0.49
CA2 P00918 3/20 0.49
PRSS1 P07477 1/20 0.47
PRSS2 P07478 1/20 0.47
PRSS3 P35030 1/20 0.47
LMNA P02545 2/20 0.45
MAPK1 P28482 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
RECQL P46063 1/20 0.43
MMP9 P14780 1/20 0.42
MMP8 P22894 1/20 0.42
MMP14 P50281 1/20 0.42
HSD17B10 Q99714 1/20 0.41
PLA2G2C Q5R387 1/20 0.40
NAAA Q02083 1/20 0.40
HCAR2 Q8TDS4 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
SCHEMBL13133102 0.87 CYP3A4 (0.58) CYP3A4TSHRATMTDP1ALDH1A1
SCHEMBL1508556 0.87 CYP3A4 (0.58) CYP3A4TSHRATMTDP1ALDH1A1
SCHEMBL38663001 0.87 CYP3A4 (0.58) CYP3A4TSHRATMTDP1ALDH1A1
SCHEMBL10027500 0.87 CYP3A4 (0.58) CYP3A4TSHRATMTDP1ALDH1A1
SCHEMBL6551468 0.85 CYP3A4 (0.50) CYP3A4TSHRATMTDP1ALDH1A1
SCHEMBL10457891 0.85 CYP3A4 (0.50) CYP3A4TSHRATMTDP1ALDH1A1
SCHEMBL2339767 0.85 CYP3A4 (0.50) CYP3A4TSHRATMTDP1ALDH1A1
SCHEMBL7137760 0.84 CYP3A4 (0.51) CYP3A4TSHRATMTDP1ALDH1A1
SCHEMBL18856341 0.84 PRSS1 (0.56) CYP3A4TSHRATMTDP1ALDH1A1
SCHEMBL10027496 0.83 CYP3A4 (0.54) CYP3A4TSHRATMTDP1ALDH1A1

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
WO-2023083202-A1 METHOD FOR ARRANGING PARTICLES, METHOD FOR MANUFACTURING ANISOTROPIC FUNCTIONAL ADHESIVE FILM, AND FUNCTIONAL PARTICLE AND MANUFACTURING METHOD THEREFOR 华为技术有限公司 2023-05-19 WO disclosed