SCHEMBL10537878

SCHEMBL10537878

CC(CC(CC(=O)O)C(=O)O)Oc1cc(Cl)c(Cl)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 1/20 0.38
FFAR1 O14842 1/20 0.38
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 2/20 0.36
RECQL P46063 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HPGD P15428 1/20 0.34
KMO O15229 1/20 0.34
FDFT1 P37268 5/20 0.34
CPA1 P15085 2/20 0.34
CPB1 P15086 1/20 0.34
CPA3 P15088 1/20 0.34
CPB2 Q96IY4 1/20 0.34
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
STING1 Q86WV6 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
SCHEMBL27635654 0.75 PPARA (0.46) TSHRTDP1L3MBTL1LMNAFFAR1
SCHEMBL11596466 0.75 LMNA (0.42) TSHRTDP1L3MBTL1LMNAFFAR1
Fenoprop SCHEMBL2419073 0.73 TSHR (0.56) TSHRTDP1L3MBTL1LMNAKDM4E
Fenoprop SCHEMBL29397851 0.73 TSHR (0.56) TSHRTDP1L3MBTL1LMNAKDM4E
Fenoprop SCHEMBL29385175 0.73 TSHR (0.56) TSHRTDP1L3MBTL1LMNAKDM4E
Fenoprop SCHEMBL55790 0.73 TSHR (0.56) TSHRTDP1L3MBTL1LMNAKDM4E
Fenoprop SCHEMBL5053997 0.73 TSHR (0.56) TSHRTDP1L3MBTL1LMNAKDM4E
SCHEMBL4181107 0.72 LMNA (0.40) TSHRTDP1L3MBTL1LMNAFFAR1
Fenoprop SCHEMBL25437012 0.72 TSHR (0.54) TSHRTDP1L3MBTL1LMNAKDM4E
Fenoprop SCHEMBL11690135 0.72 TSHR (0.54) TSHRTDP1L3MBTL1LMNAKDM4E

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-4846883-A AROMATIC OXYALKYL ESTERS REANAL FINOMVEGYSZERGYAR (HU) 1989-07-11 US disclosed