SCHEMBL7854404

SCHEMBL7854404

[CH2]CCCC(C)C(=O)OCCC

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.38
ALDH1A1 P00352 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 3/20 0.33
HPGD P15428 1/20 0.33
FAAH O00519 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33
CA2 P00918 1/20 0.32
LMNA P02545 1/20 0.32
ACE2 Q9BYF1 1/20 0.32
ATM Q13315 1/20 0.31

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
SCHEMBL27533711 0.91 ALDH1A1 (0.45) CA1ALDH1A1SMN1; SMN2TSHRHPGD
SCHEMBL27756272 0.88 ALDH1A1 (0.36) CA1ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL9324785 0.87 TSHR (0.47) CA1ALDH1A1TSHRFAAHHCAR2
SCHEMBL7218218 0.86 CA1 (0.47) CA1ALDH1A1TSHRCA2ACE2
SCHEMBL9302171 0.84 CA1 (0.46) CA1ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL8569409 0.84 ALDH1A1 (0.37) CA1ALDH1A1MEN1KMT2ALMNA
SCHEMBL7217047 0.84 CA1 (0.55) CA1FAAHACE2
SCHEMBL17827489 0.84 CA1 (0.55) CA1FAAHACE2
SCHEMBL17435172 0.82 CA1 (0.53) CA1FAAHACE2
SCHEMBL7223212 0.82 CA1 (0.53) CA1FAAHACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0719258-B1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMA CO LTD (JP) 2001-10-31 EP disclosed
US-5786367-A OXYGEN SCAVENGERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-07-28 US disclosed
EP-0719258-A1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-07-03 EP disclosed
WO-1996002508-A1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-02-01 WO disclosed