SCHEMBL8961806

SCHEMBL8961806

[CH2]CCC(CC=C)Oc1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.36
POLB P06746 1/20 0.34
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SLC6A4 P31645 1/20 0.33
TSHR P16473 1/20 0.33
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
THRB P10828 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
SCHEMBL1778182 0.87 CYP2C19 (0.41) CYP2C19POLBKDM4EALDH1A1SMN1; SMN2
SCHEMBL2108376 0.84 CYP2C19 (0.39) CYP2C19KDM4EALDH1A1SMN1; SMN2SLC6A4
SCHEMBL10903531 0.80 CYP2C19 (0.42) CYP2C19KDM4EALDH1A1SMN1; SMN2ALOX15
SCHEMBL27722724 0.80 CYP2C19 (0.37) CYP2C19POLBKDM4EALDH1A1SMN1; SMN2
SCHEMBL1811046 0.80 CYP2C19 (0.41) CYP2C19KDM4EALDH1A1SMN1; SMN2PPARG
SCHEMBL10514058 0.79 CYP2C19 (0.40) CYP2C19POLBKDM4EALDH1A1SMN1; SMN2
Hydrogen Sulfide SCHEMBL28172430 0.79 KMT2A (0.37) CYP2C19POLBKDM4EALDH1A1SMN1; SMN2
SCHEMBL10933718 0.78 SLC6A4 (0.39) POLBKDM4EALDH1A1MAPTSLC6A4
SCHEMBL1684306 0.77 CYP2C19 (0.35) CYP2C19POLBSMN1; SMN2
SCHEMBL4411899 0.77 CYP2C19 (0.40) CYP2C19KDM4EALDH1A1SMN1; SMN2ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0564275-B1 Antifouling paint NIPPON PAINT CO LTD (JP) 1996-01-31 EP disclosed
US-5332431-A Alkylphenoxy group containing organosilicon compound NIPPON PAINT CO., LTD. (JP) 1994-07-26 US disclosed
EP-0564275-A1 Antifouling paint NIPPON PAINT CO., LTD. (JP) 1993-10-06 EP disclosed