SCHEMBL8987386

SCHEMBL8987386

CCCCCCC(CCCC)COC(=O)N(C)C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.38
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37
CYP3A4 P08684 4/20 0.37
TSHR P16473 2/20 0.37
ATM Q13315 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
DUSP3 P51452 1/20 0.36
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 1/20 0.35
ABCB1 P08183 1/20 0.34
CYP2D6 P10635 2/20 0.34
SPHK1 Q9NYA1 1/20 0.34
GMNN O75496 1/20 0.34
POLB P06746 1/20 0.34
THPO P40225 1/20 0.34

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
SCHEMBL2321053 0.91 CYP3A4 (0.47) LMNAPRSS1PRSS2PRSS3CYP3A4
SCHEMBL5187222 0.83 NAAA (0.40) LMNATSHRKDM4EMEN1KMT2A
SCHEMBL7906767 0.83 NAAA (0.40) LMNATSHRKDM4EMEN1KMT2A
SCHEMBL1008681 0.83 NAAA (0.40) LMNATSHRKDM4EMEN1KMT2A
SCHEMBL7906758 0.83 NAAA (0.40) LMNATSHRKDM4EMEN1KMT2A
SCHEMBL7553699 0.83 NAAA (0.40) LMNATSHRKDM4EMEN1KMT2A
SCHEMBL28378208 0.83 NAAA (0.40) LMNATSHRKDM4EMEN1KMT2A
SCHEMBL7906801 0.83 NAAA (0.40) LMNATSHRKDM4EMEN1KMT2A
SCHEMBL8798951 0.83 NAAA (0.40) LMNATSHRKDM4EMEN1KMT2A
SCHEMBL9019436 0.82 CYP2D6 (0.39) LMNACYP3A4KDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5587169-A COMPRISING NONIONIC HYDROXYLATED GROUP; PROTECTIVE CREAM L'OREAL (FR) 1996-12-24 US claimed
US-5587169-A COMPRISING NONIONIC HYDROXYLATED GROUP; PROTECTIVE CREAM L'OREAL (FR) 1996-12-24 US disclosed