SCHEMBL18537030

SCHEMBL18537030

CCC(C)(C)OC1C(CO)OC(C(C)(C)CC)C(NC(C)=O)C1O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.42
▸ THRB P10828 1/20 0.42
▸ LGALS3 P17931 6/20 0.39
▸ LGALS8 O00214 1/20 0.39
▸ LGALS4 P56470 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ CD69 Q07108 1/20 0.36
▸ CHIA Q9BZP6 1/20 0.35
▸ LGALS1 P09382 1/20 0.35
▸ LGALS7; LGALS7B P47929 1/20 0.35
▸ PYGB P11216 1/20 0.34
▸ LGALS9 O00182 1/20 0.34

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
SCHEMBL17992416 0.92 MAPK1 (0.41) MAPK1ALDH1A1THRBLGALS3LGALS8
SCHEMBL18537029 0.90 MAPK1 (0.46) MAPK1ALDH1A1THRBLGALS3LGALS8
SCHEMBL17992414 0.87 MAPK1 (0.41) MAPK1ALDH1A1THRBLGALS3LGALS8
SCHEMBL26318920 0.84 ALDH1A1 (0.53) MAPK1ALDH1A1THRBLGALS3LGALS8
SCHEMBL22892276 0.81 MAPK1 (0.46) MAPK1ALDH1A1THRBLGALS3LGALS8
SCHEMBL18537059 0.80 L3MBTL1 (0.36) —
SCHEMBL18389052 0.78 ALDH1A1 (0.48) MAPK1ALDH1A1THRBLGALS3LGALS8
SCHEMBL10330881 0.78 LGALS3 (0.47) MAPK1ALDH1A1THRBLGALS3LGALS8
SCHEMBL22652630 0.78 MAPK1 (0.44) MAPK1ALDH1A1THRBLGALS3LGALS8
SCHEMBL22021796 0.77 ALDH1A1 (0.62) MAPK1ALDH1A1THRBLGALS3LGALS8

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-2980889-B1 ELECTRODE FOR RECHARGEABLE LITHIUM BATTERY COMPRISING A BINDER COMPOSITION AND RECHARGEABLE LITHIUM BATTERY INCLUDING SAME SAMSUNG SDI CO LTD (KR) 2017-02-22 — — EP disclosed
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