SCHEMBL6925947

SCHEMBL6925947

CCCCCCCCCc1cc(OC(=O)COCCOCCOCCOCCOCCOCCO)ccc1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
ALDH1A1 P00352 2/20 0.48
USP2 O75604 1/20 0.48
LMNA P02545 1/20 0.48
CYP3A4 P08684 1/20 0.48
MAPK1 P28482 1/20 0.48
CASP1 P29466 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
SLCO1B3 Q9NPD5 1/20 0.48
SLCO1B1 Q9Y6L6 1/20 0.48
CNR2 P34972 8/20 0.43
TSHR P16473 1/20 0.43
CNR1 P21554 1/20 0.43
PRSS1 P07477 1/20 0.41
ACR P10323 1/20 0.41
THRB P10828 1/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 1/20 0.39
MTNR1A P48039 1/20 0.39

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
Hexaethylene Glycol SCHEMBL6925944 0.90 MEN1 (0.51) MEN1KMT2AALDH1A1USP2LMNA
SCHEMBL4304170 0.89 MTNR1A (0.36) MEN1KMT2AALDH1A1USP2LMNA
SCHEMBL8027527 0.83 MEN1 (0.65) MEN1KMT2AALDH1A1USP2LMNA
SCHEMBL8013195 0.83 MEN1 (0.65) MEN1KMT2AALDH1A1USP2LMNA
Hexaethylene Glycol SCHEMBL8026237 0.83 MEN1 (0.45) MEN1KMT2AALDH1A1USP2LMNA
SCHEMBL11372256 0.81 TSHR (0.48) MEN1KMT2AALDH1A1CYP3A4CNR2
SCHEMBL4308107 0.81 MTNR1A (0.37) MEN1KMT2AALDH1A1CNR2TSHR
Ethylene Glycol SCHEMBL6925942 0.78 ALOX5 (0.51) MEN1KMT2ACYP3A4CNR2TSHR
SCHEMBL11781460 0.78 HTR1A (0.51) MEN1KMT2AALDH1A1MAPK1SMN1; SMN2
SCHEMBL13750505 0.77 MTNR1A (0.34) ALDH1A1CNR2MTNR1AMTNR1B

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-0801117-B1 Antifouling resin composition NIPPON PAINT CO LTD (JP) 2003-11-26 EP disclosed
US-6123755-A DOES NOT ELUTE ANTIFOULING COMPOUNDS, DURABLE NIPPON PAINT CO., LTD. (JP) 2000-09-26 US disclosed
EP-0801117-A2 Antifouling resin composition Nippon Paint Co., Ltd. (JP) 1997-10-15 EP disclosed