SCHEMBL8993611

SCHEMBL8993611

CCCCC(=CCCO)CCCC

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
TSHR P16473 3/20 0.38
LMNA P02545 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CES1 P23141 2/20 0.36
CES2 O00748 1/20 0.36
TP53 P04637 1/20 0.33
CA1 P00915 1/20 0.32
EP300 Q09472 1/20 0.31

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
SCHEMBL27142984 0.91 LMNA (0.46) ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10
SCHEMBL20960104 0.91 LMNA (0.46) ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10
SCHEMBL1034694 0.91 LMNA (0.46) ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10
SCHEMBL20960130 0.91 LMNA (0.46) ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10
SCHEMBL27149986 0.91 LMNA (0.46) ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10
SCHEMBL31528913 0.88 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10
SCHEMBL11773426 0.86 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10
SCHEMBL11773433 0.86 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10
SCHEMBL38749 0.84 ALDH1A1 (0.39) ALDH1A1TSHRLMNAHSD17B10MEN1
SCHEMBL31130683 0.84 CES1 (0.39) ALDH1A1TSHRLMNAHSD17B10MEN1

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
EP-0723596-A1 METHOD FOR THE ENZYMATIC TRANSFORMATION OF TRIGLYCERIDES IN A FAT, IN PARTICULAR DAIRY FAT CENTRE DE COOPERATION INTERNATIONAL EN RECHERCHE AGRONOMIQUE POUR LE DEVELOPPEMENT ( CIRAD) (FR) 1996-07-31 EP disclosed
WO-1995010626-A1 METHOD FOR THE ENZYMATIC TRANSFORMATION OF TRIGLYCERIDES IN A FAT, IN PARTICULAR DAIRY FAT CENTRE DE COOPERATION INTERNATIONALE EN RECHERCHE AGRONOMIQUE POUR LE DEVELOPPEMENT (FR) 1995-04-20 WO disclosed