SCHEMBL7158191

SCHEMBL7158191

CC=CCCC=CC(O)CC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAPDH P04406 1/20 0.44
CMKLR1 Q99788 1/20 0.33
HDAC2 Q92769 3/20 0.32
SPHK2 Q9NRA0 2/20 0.32
SPHK1 Q9NYA1 2/20 0.32
CETP P11597 1/20 0.32
PPARG P37231 1/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32
CYP3A4 P08684 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TSHR P16473 1/20 0.30
USP2 O75604 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
RECQL P46063 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30

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
SCHEMBL7158189 1.00 GAPDH (0.44) GAPDHCMKLR1HDAC2SPHK2SPHK1
SCHEMBL17459808 0.98 GAPDH (0.43) GAPDHCMKLR1HDAC2SPHK2SPHK1
SCHEMBL17459810 0.98 GAPDH (0.43) GAPDHCMKLR1HDAC2SPHK2SPHK1
SCHEMBL28092169 0.84 GAPDH (0.50) GAPDHCMKLR1PPARGPPARDPPARA
SCHEMBL8445029 0.82
SCHEMBL8445030 0.82
SCHEMBL7877000 0.81 GAPDH (0.41) GAPDHCMKLR1HDAC2SPHK2SPHK1
SCHEMBL7876999 0.81 GAPDH (0.41) GAPDHCMKLR1HDAC2SPHK2SPHK1
SCHEMBL5868415 0.80
SCHEMBL5868418 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4301834-A1 USE OF ENZYMES FOR IMPROVING FRAGRANCE DEPOSITION Novozymes A/S (DK) 2024-01-10 EP disclosed
CN-114096235-A Antimicrobial compositions 弗门尼舍有限公司 2022-02-25 CN disclosed
EP-1416792-A1 WATER-IN-OIL POLYMER DISPERSION AS ADDITIVE IN COMPOSITIONS CONTAINING ACTIVE INGREDIENTS Goldschmidt AG (DE) 2004-05-12 EP disclosed
WO-2003015512-A1 WATER-IN-OIL POLYMER DISPERSION AS ADDITIVE IN COMPOSITIONS CONTAINING ACTIVE INGREDIENTS GOLDSCHMIDT AG (DE) 2003-02-27 WO disclosed