SCHEMBL8894625

SCHEMBL8894625

[CH2]C(=O)OCC1CCCC1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.52
PARP15 Q460N3 3/20 0.42
PARP10 Q53GL7 3/20 0.42
SLC1A3 P43003 4/20 0.40
SLC1A2 P43004 4/20 0.40
SLC1A1 P43005 4/20 0.40
PARP2 Q9UGN5 1/20 0.38
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX5 P09917 1/20 0.34
EPHX1 P07099 2/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
NAAA Q02083 1/20 0.33
MGLL Q99685 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 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
SCHEMBL8894600 0.98 LMNA (0.55) LMNAPARP15PARP10SLC1A3SLC1A2
SCHEMBL8895546 0.98 LMNA (0.55) LMNAPARP15PARP10SLC1A3SLC1A2
SCHEMBL1672623 0.80 LMNA (0.55) LMNAPARP15PARP10SLC1A3SLC1A2
SCHEMBL1669840 0.78 LMNA (0.59) LMNAPARP15PARP10SLC1A3SLC1A2
SCHEMBL8396781 0.78 LMNA (0.53) LMNAPARP15PARP10SLC1A3SLC1A2
SCHEMBL4463734 0.78 LMNA (0.59) LMNAPARP15PARP10SLC1A3SLC1A2
SCHEMBL8896771 0.77 LMNA (0.58) LMNAPARP15PARP10SLC1A3SLC1A2
SCHEMBL697999 0.77 LMNA (0.48) LMNAPARP15PARP10SLC1A3SLC1A2
SCHEMBL8894774 0.77 EPHX1 (0.42) LMNAEPHX1NAAAHPGD
SCHEMBL23129641 0.76 LMNA (0.57) LMNAPARP15PARP10SLC1A3SLC1A2

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-5670563-A ORGANOTIN COMPOUND, PHOSPHORUS COMPOUND CIBA-SPECIALTY CHEMICALS CORPORATION (US) 1997-09-23 US disclosed