SCHEMBL29930396

SCHEMBL29930396

CCCCCCCCOC(=O)C(C)c1cc(-n2nc3ccccc3n2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
TSHR P16473 4/20 0.36
LMNA P02545 2/20 0.36
F2R P25116 1/20 0.36
NPSR1 Q6W5P4 5/20 0.35
KDM4E B2RXH2 2/20 0.35
HSD17B10 Q99714 2/20 0.35
KMT2A Q03164 4/20 0.35
MAPT P10636 3/20 0.35
MEN1 O00255 3/20 0.35
USP2 O75604 3/20 0.35
CASP1 P29466 2/20 0.35
HTT P42858 2/20 0.35
APP P05067 1/20 0.35
GAA P10253 1/20 0.35
SNCA P37840 1/20 0.35
TP53 P04637 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL30963008 1.00 ALDH1A1 (0.36) ALDH1A1TSHRLMNAF2RNPSR1
SCHEMBL3858691 1.00 ALDH1A1 (0.36) ALDH1A1TSHRLMNAF2RNPSR1
SCHEMBL30963009 1.00 ALDH1A1 (0.36) ALDH1A1TSHRLMNAF2RNPSR1
SCHEMBL135175 0.90 PSEN1 (0.38) ALDH1A1KDM4EL3MBTL1
SCHEMBL29603281 0.90 PSEN1 (0.38) ALDH1A1KDM4EL3MBTL1
SCHEMBL8050303 0.88 PTGS2 (0.33) HTT
SCHEMBL28940118 0.88 NPC1 (0.40) ALDH1A1TSHRLMNAF2RNPSR1
SCHEMBL7156726 0.87 NPC1 (0.36) ALDH1A1LMNAF2RNPSR1KDM4E
SCHEMBL7531465 0.87 ALDH1A1 (0.37) ALDH1A1TSHRLMNAF2RNPSR1
SCHEMBL2952892 0.85 ALDH1A1 (0.42) ALDH1A1TSHRLMNAF2RNPSR1

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-119570434-B Outdoor special pressure-sensitive adhesive with strong stripping force and preparation method thereof 畅的新材料科技(上海)有限公司 2025-05-27 CN disclosed
CN-114096408-B Resin composition for optical film 斯瓦蒙卢森堡公司 2024-04-12 CN disclosed