SCHEMBL29684447

SCHEMBL29684447

C=CC(=O)Nc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 11/20 0.72
F13A1 P00488 1/20 0.58
LMNA P02545 1/20 0.58
TGM1 P22735 1/20 0.58
TGM3 Q08188 1/20 0.58
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
ALDH1A1 P00352 2/20 0.54
MAPT P10636 1/20 0.54
CYP19A1 P11511 2/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
KDM4E B2RXH2 1/20 0.49
POLB P06746 1/20 0.49
DEGS1 O15121 1/20 0.47
PTPN1 P18031 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL13586721 0.90 TGM2 (0.64) TGM2F13A1LMNATGM1TGM3
SCHEMBL39036 0.89 TGM2 (0.72) TGM2F13A1LMNATGM1TGM3
SCHEMBL8459308 0.85 TGM2 (0.57) TGM2ALDH1A1CYP19A1RAB9A
SCHEMBL81209 0.85 TGM2 (1.00) TGM2F13A1LMNATGM1TGM3
SCHEMBL890715 0.83 TGM2 (0.68) TGM2F13A1LMNATGM1TGM3
SCHEMBL30211836 0.83 TGM2 (0.96) TGM2F13A1LMNATGM1TGM3
SCHEMBL28240522 0.83 TGM2 (0.96) TGM2F13A1LMNATGM1TGM3
SCHEMBL439369 0.82 TGM2 (0.79) TGM2F13A1LMNATGM1TGM3
SCHEMBL19501652 0.81 TGM2 (0.85) TGM2F13A1LMNATGM1TGM3
SCHEMBL1383664 0.81 TGM2 (0.78) TGM2F13A1LMNATGM1TGM3

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-114656656-A Thermochromic fluorescent oil hydrogel and preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2022-06-24 CN claimed
CN-114656656-A Thermochromic fluorescent oil hydrogel and preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2022-06-24 CN disclosed