SCHEMBL28530105

SCHEMBL28530105

CCCCCCCCCCCCS(CCCCCCCCCCCC)(CCCCCCCCCCCC)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.44
▸ PSIP1 O75475 1/20 0.41
▸ DNM1 Q05193 2/20 0.40
▸ PCSK9 Q8NBP7 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ EPHX2 P34913 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ CES2 O00748 1/20 0.39
▸ CES1 P23141 1/20 0.39
▸ ABCB1 P08183 1/20 0.39
▸ KCNH2 Q12809 1/20 0.38
▸ NAAA Q02083 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
SCHEMBL21712439 0.91 TDP1 (0.47) TDP1PSIP1PCSK9SMN1; SMN2PKM
SCHEMBL11034752 0.88 TDP1 (0.40) TDP1PSIP1DNM1PCSK9MEN1
SCHEMBL3412526 0.83 TDP1 (0.44) TDP1PSIP1DNM1PCSK9MEN1
SCHEMBL1286162 0.83 TDP1 (0.44) TDP1PSIP1DNM1PCSK9MEN1
SCHEMBL28376769 0.83 TDP1 (0.44) TDP1PSIP1DNM1PCSK9MEN1
SCHEMBL27943041 0.83 TDP1 (0.44) TDP1PSIP1DNM1PCSK9MEN1
SCHEMBL7596391 0.80 TDP1 (0.46) TDP1PSIP1DNM1PCSK9CES2
SCHEMBL588204 0.79 PSIP1 (0.59) TDP1PSIP1
SCHEMBL8778748 0.79 PSIP1 (0.59) TDP1PSIP1
SCHEMBL5963682 0.79 PSIP1 (0.59) TDP1PSIP1

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-109994288-B Forming rigid armored cables with curable jacket 德莎欧洲股份公司 2021-02-26 — — CN disclosed
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