SCHEMBL7948997

SCHEMBL7948997

COC(=O)CCCCC=C(C)CCCCCCCO

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
ALDH1A1 P00352 1/20 0.54
SQLE Q14534 3/20 0.50
TSHR P16473 3/20 0.45
EPHX2 P34913 1/20 0.43
CNR2 P34972 1/20 0.40
TBXAS1 P24557 1/20 0.39
RECQL P46063 1/20 0.38
KMT2A Q03164 1/20 0.36
HPGD P15428 1/20 0.36
POLB P06746 1/20 0.36
POLA1 P09884 1/20 0.36

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
SCHEMBL7948993 1.00 LMNA (0.54) LMNAALDH1A1SQLETSHREPHX2
SCHEMBL16021161 0.87 LMNA (0.54) LMNAALDH1A1TSHREPHX2CNR2
SCHEMBL11577022 0.85 ALDH1A1 (0.56) LMNAALDH1A1TSHREPHX2CNR2
SCHEMBL11577020 0.85 ALDH1A1 (0.56) LMNAALDH1A1TSHREPHX2CNR2
SCHEMBL7949308 0.83 LMNA (0.50) LMNAALDH1A1TSHREPHX2CNR2
SCHEMBL7951003 0.83 LMNA (0.50) LMNAALDH1A1TSHREPHX2CNR2
SCHEMBL7949305 0.83 LMNA (0.50) LMNAALDH1A1TSHREPHX2CNR2
SCHEMBL25400130 0.82 ALDH1A1 (0.61) LMNAALDH1A1TSHREPHX2CNR2
SCHEMBL7941250 0.82 ALDH1A1 (0.61) LMNAALDH1A1TSHREPHX2CNR2
SCHEMBL3706941 0.82 ALDH1A1 (0.61) LMNAALDH1A1TSHREPHX2CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6255276-B1 MUSK MACROMOLECULE GIVAUDEN ROURE (INTERNATIONAL) S.A. (CH) 2001-07-03 US disclosed
EP-0908455-A1 Macrocycles GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 1999-04-14 EP disclosed