SCHEMBL20006788

SCHEMBL20006788

CCC(=O)NCCNC(=O)CCCCC1SC[C@@H]2NC(=O)N[C@H]12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 5/20 0.67
▸ PKM P14618 2/20 0.64
▸ MEN1 O00255 1/20 0.64
▸ ABL1 P00519 1/20 0.64
▸ LMNA P02545 1/20 0.64
▸ IDE P14735 1/20 0.64
▸ MAPK1 P28482 1/20 0.64
▸ KMT2A Q03164 1/20 0.64
▸ RIN1 Q13671 1/20 0.64
▸ L3MBTL1 Q9Y468 1/20 0.64
▸ CA12 O43570 3/20 0.62
▸ CA1 P00915 3/20 0.62
▸ CA2 P00918 3/20 0.62
▸ CA9 Q16790 3/20 0.62
▸ HLCS P50747 3/20 0.61
▸ F2 P00734 1/20 0.61
▸ PRSS1 P07477 1/20 0.61
▸ PRSS2 P07478 1/20 0.61
▸ PRSS3 P35030 1/20 0.61
▸ TPSAB1 Q15661 1/20 0.61

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
SCHEMBL20006677 0.95 TDP1 (0.71) TDP1PKMMEN1ABL1LMNA
SCHEMBL9412852 0.94 TDP1 (0.74) TDP1PKMMEN1ABL1LMNA
SCHEMBL17128734 0.93 TDP1 (0.67) TDP1PKMMEN1ABL1LMNA
SCHEMBL31677482 0.92 TDP1 (0.66) TDP1PKMMEN1ABL1LMNA
SCHEMBL24179756 0.92 TDP1 (0.69) TDP1PKMMEN1ABL1LMNA
SCHEMBL10063351 0.92 TDP1 (0.69) TDP1PKMMEN1ABL1LMNA
SCHEMBL12735634 0.92 TDP1 (0.69) TDP1PKMMEN1ABL1LMNA
SCHEMBL22560803 0.92 TDP1 (0.69) TDP1PKMMEN1ABL1LMNA
SCHEMBL10036929 0.92 TDP1 (0.69) TDP1PKMMEN1ABL1LMNA
SCHEMBL26551954 0.92 TDP1 (0.69) TDP1PKMMEN1ABL1LMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2552202-B1 METHODS AND COMPOSITIONS FOR WEIGHT LOSS SDG INC (US) 2023-07-26 — — EP disclosed
EP-3391876-B1 LIPID CONSTRUCT FOR DELIVERY OF INSULIN TO A MAMMAL SDG INC (US) 2021-03-10 — — EP disclosed
EP-1883394-B1 LIPID CONSTRUCT FOR DELIVERY OF INSULIN TO A MAMMAL SDG INC (US) 2018-03-28 — — EP disclosed
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