SCHEMBL11313291

SCHEMBL11313291

CO[C@H]1C[C@@H](NC(=O)C(F)(F)F)[C@@H](O)[C@H](C)O1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DGAT2 Q96PD7 1/20 0.37
▸ MEN1 O00255 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ ABCC3 O15438 1/20 0.35
▸ ABCC4 O15439 1/20 0.35
▸ ABCB11 O95342 1/20 0.35
▸ ABCC2 Q92887 1/20 0.35
▸ ASGR1 P07306 1/20 0.33
▸ HPSE Q9Y251 1/20 0.32
▸ STAT3 P40763 5/20 0.32

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
SCHEMBL11160918 1.00 DGAT2 (0.37) DGAT2MEN1LMNATHRBHTT
SCHEMBL11153114 1.00 DGAT2 (0.37) DGAT2MEN1LMNATHRBHTT
SCHEMBL11421254 1.00 DGAT2 (0.37) DGAT2MEN1LMNATHRBHTT
SCHEMBL11414378 1.00 DGAT2 (0.37) DGAT2MEN1LMNATHRBHTT
SCHEMBL19852932 1.00 DGAT2 (0.37) DGAT2MEN1LMNATHRBHTT
SCHEMBL11420286 0.87 — —
SCHEMBL11420289 0.87 — —
SCHEMBL11039306 0.86 ASGR1 (0.33) ASGR1
SCHEMBL19799344 0.85 MEN1 (0.32) MEN1LMNATHRBHTTKMT2A
SCHEMBL21168495 0.85 MEN1 (0.35) MEN1LMNATHRBHTTKMT2A

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
US-4276289-A ANTHRACYCLINE FARMITALIA CARLO ERBA, S.P.A. (IT) 1981-06-30 — — US disclosed
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