SCHEMBL9117004

SCHEMBL9117004

C=CC(C(=O)O)=C(C(=O)OCCCC)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
TSHR P16473 7/20 0.45
TDP1 Q9NUW8 4/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
HPGD P15428 2/20 0.45
LMNA P02545 6/20 0.43
ALDH1A1 P00352 4/20 0.42
MAPK1 P28482 3/20 0.42
CYP3A4 P08684 3/20 0.42
TP53 P04637 1/20 0.41
HSD17B10 Q99714 1/20 0.40
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2C19 P33261 2/20 0.40
ESR1 P03372 1/20 0.40
CYP2D6 P10635 1/20 0.40
NR1H2 P55055 1/20 0.40
RNASEL Q05823 1/20 0.40

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
SCHEMBL11860940 0.85 TSHR (0.56) KDM4ETSHRTDP1L3MBTL1HPGD
SCHEMBL26670106 0.85 TSHR (0.56) KDM4ETSHRTDP1L3MBTL1HPGD
SCHEMBL4544966 0.81 TSHR (0.51) KDM4ETSHRTDP1L3MBTL1HPGD
SCHEMBL13703243 0.78 TSHR (0.49) KDM4ETSHRTDP1L3MBTL1HPGD
SCHEMBL27657137 0.78 TSHR (0.45) KDM4ETSHRTDP1L3MBTL1HPGD
Acrylic Acid SCHEMBL27869586 0.77 LMNA (0.65) TSHRTDP1L3MBTL1HPGDLMNA
SCHEMBL316833 0.76 TSHR (0.53) KDM4ETSHRTDP1L3MBTL1LMNA
SCHEMBL8633590 0.76 TSHR (0.46) KDM4ETSHRTDP1L3MBTL1HPGD
SCHEMBL8633599 0.76 TSHR (0.46) KDM4ETSHRTDP1L3MBTL1HPGD
SCHEMBL9095382 0.76 CES2 (0.56) KDM4ETSHRTDP1L3MBTL1LMNA

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-5424164-A Image forming method FUJI PHOTO FILM CO., LTD (JP) 1995-06-13 US disclosed