SCHEMBL31682008

SCHEMBL31682008

CC(C)(C)OC(=O)CCCCCCCc1ccc(CCOc2ccc(S(=O)(=O)Nc3ncc(C(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)O)cn3)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.37
PKM P14618 1/20 0.37
GPR35 Q9HC97 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TBXA2R P21731 1/20 0.34
TBXAS1 P24557 1/20 0.34
CA2 P00918 5/20 0.34
CA12 O43570 4/20 0.34
CA1 P00915 4/20 0.34
CA9 Q16790 4/20 0.34
PPARA Q07869 2/20 0.34
HDAC1 Q13547 2/20 0.33
SUCNR1 Q9BXA5 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33

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
SCHEMBL31681973 0.96 ALDH1A1 (0.37) SMN1; SMN2PKMTDP1ALDH1A1MEN1
SCHEMBL22029360 0.96 ALDH1A1 (0.37) SMN1; SMN2PKMTDP1ALDH1A1MEN1
SCHEMBL31682112 0.96 ALDH1A1 (0.37) SMN1; SMN2PKMTDP1ALDH1A1MEN1
SCHEMBL31681981 0.95 TDP1 (0.38) SMN1; SMN2PKMGPR35TDP1ALDH1A1
SCHEMBL31682032 0.94 SMN1; SMN2 (0.41) SMN1; SMN2PKMTDP1CA2CA12
SCHEMBL22029342 0.94 SMN1; SMN2 (0.41) SMN1; SMN2PKMTDP1CA2CA12
SCHEMBL31682006 0.93 HDAC1 (0.40) SMN1; SMN2PKMGPR35ALDH1A1MEN1
SCHEMBL31682004 0.93 HDAC1 (0.40) SMN1; SMN2PKMGPR35ALDH1A1MEN1
SCHEMBL24257961 0.92 SMN1; SMN2 (0.39) SMN1; SMN2PKMTDP1ALDH1A1MEN1
SCHEMBL22080442 0.92 SMN1; SMN2 (0.39) SMN1; SMN2PKMTDP1ALDH1A1MEN1

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