SCHEMBL31411075

SCHEMBL31411075

CC(C)(C)OC(=O)COCCOCCOCCOCCOCCOc1ccc(Br)cn1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.43
KDM4E B2RXH2 4/20 0.42
LSS P48449 3/20 0.36
FPR2 P25090 2/20 0.34
NPC1 O15118 1/20 0.33
RECQL P46063 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
APP P05067 3/20 0.33
ALDH1A1 P00352 3/20 0.33
MAPT P10636 1/20 0.33
SNCA P37840 1/20 0.33
GABRA5 P31644 1/20 0.32
HSD11B1 P28845 1/20 0.32
HSD11B2 P80365 1/20 0.32
LATS1 O95835 1/20 0.32
GPR119 Q8TDV5 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL20120763 1.00 DGAT1 (0.43) DGAT1KDM4ELSSFPR2NPC1
SCHEMBL22907011 1.00 DGAT1 (0.43) DGAT1KDM4ELSSFPR2NPC1
SCHEMBL30556450 0.99 DGAT1 (0.43) DGAT1KDM4ELSSFPR2NPC1
SCHEMBL31274495 0.99 DGAT1 (0.43) DGAT1KDM4ELSSFPR2NPC1
SCHEMBL17941145 0.90 DGAT1 (0.43) DGAT1KDM4ELSSFPR2NPC1
SCHEMBL23348624 0.86 KDM4E (0.50) DGAT1KDM4EFPR2NPC1RECQL
SCHEMBL23720486 0.81 BCHE (0.43) DGAT1KDM4EFPR2NPC1RECQL
SCHEMBL31108106 0.81 CCNB2 (0.34) DGAT1KDM4EFPR2ALDH1A1LATS1
SCHEMBL25259501 0.81 FPR2 (0.35) KDM4EFPR2NPC1RAB9ASMN1; SMN2
SCHEMBL21405025 0.81 FPR2 (0.35) KDM4EFPR2NPC1RAB9ASMN1; SMN2

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-119954801-A TAU protein targeting compounds and related methods of use 阿尔维纳斯运营股份有限公司 2025-05-09 CN disclosed
CN-114867727-B TAU protein targeting compounds and related methods of use 阿尔维纳斯运营股份有限公司 2025-02-21 CN disclosed