SCHEMBL31681995

SCHEMBL31681995

CC(C)(C)OC(=O)CCCCCCCCCCCc1cccc(S(=O)(=O)Nc2ncc(C(=O)O)cn2)c1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 9/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ AKR1C3 P42330 4/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL31682048 1.00 NAMPT (0.40) NAMPTMEN1KMT2AAKR1C3TDP1
SCHEMBL31682041 0.90 HDAC3 (0.44) NAMPTMEN1KMT2AAKR1C3
SCHEMBL31682016 0.90 HDAC3 (0.44) NAMPTMEN1KMT2AAKR1C3
SCHEMBL31682047 0.90 HDAC3 (0.44) NAMPTMEN1KMT2AAKR1C3
SCHEMBL31682097 0.88 TBXA2R (0.43) TDP1
SCHEMBL31681966 0.88 TBXA2R (0.43) TDP1
SCHEMBL31682020 0.88 TBXA2R (0.43) TDP1
SCHEMBL31682107 0.87 FABP1 (0.44) MEN1KMT2ATDP1
SCHEMBL31682086 0.86 NAMPT (0.43) NAMPTMEN1KMT2A
SCHEMBL22105998 0.83 NAMPT (0.38) NAMPTMEN1KMT2AAKR1C3TDP1

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
EP-3893934-B1 INSULIN CONJUGATES SANOFI SA (FR) 2025-09-10 — — EP disclosed
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