SCHEMBL10396191

SCHEMBL10396191

C=C(C)C(=O)OC(c1ccc(C(OC(=O)C(=C)C)(C(F)(F)F)C(F)(F)F)cc1)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 4/20 0.37
MAPT P10636 4/20 0.37
LMNA P02545 3/20 0.37
ALDH1A1 P00352 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
ELANE P08246 1/20 0.33
MLYCD O95822 2/20 0.32
KDM4E B2RXH2 1/20 0.32
USP2 O75604 1/20 0.32
HPGD P15428 1/20 0.32
CYP2C19 P33261 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KMT2A Q03164 4/20 0.32
MEN1 O00255 2/20 0.32
NR4A1 P22736 1/20 0.32
NR4A2 P43354 1/20 0.32
NR4A3 Q92570 1/20 0.32
XBP1 P17861 1/20 0.32
HTT P42858 1/20 0.32
PAX8 Q06710 1/20 0.32

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
SCHEMBL7084775 0.93 RORC (0.38) NPSR1MAPTLMNASMN1; SMN2KMT2A
SCHEMBL24908565 0.93 ESR1 (0.40) NPSR1MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL15840364 0.92 SMN1; SMN2 (0.47) NPSR1LMNASMN1; SMN2MLYCDHTT
SCHEMBL3692621 0.91 ELANE (0.41) NPSR1MAPTLMNAALDH1A1ELANE
SCHEMBL2465362 0.86 PGK1 (0.40) NPSR1ALDH1A1SMN1; SMN2ELANEKMT2A
SCHEMBL10396190 0.85 LMNA (0.38) NPSR1MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL26794304 0.85 ESR1 (0.41)
SCHEMBL26794329 0.82 ESR1 (0.32) NPSR1MAPTLMNAKMT2AMEN1
SCHEMBL10584097 0.82 ELANE (0.38) NPSR1MAPTLMNAALDH1A1ELANE
SCHEMBL26862665 0.81 CYP3A4 (0.37) NPSR1MAPTLMNAALDH1A1KMT2A

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-4910275-A Copolymer of an acrylated polyether and an acrylated ester DAIKIN INDUSTRIES, LTD. (JP) 1990-03-20 US disclosed