SCHEMBL9630998

SCHEMBL9630998

CCCCCC(C)CCCC(C)CCCC(C)CCCC(C)C=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.47
ADH1B P00325 1/20 0.44
ADH1C P00326 1/20 0.44
ADH1A P07327 1/20 0.44
ADH4 P08319 1/20 0.44
ADH7 P40394 1/20 0.44
LMNA P02545 1/20 0.42
TSHR P16473 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
OPRM1 P35372 1/20 0.39
TRPA1 O75762 1/20 0.38
DDAH1 O94760 1/20 0.38
GAPDH P04406 1/20 0.38
MAPT P10636 1/20 0.38
CA1 P00915 2/20 0.38
TP53 P04637 1/20 0.36
FDPS P14324 4/20 0.34
PRKD3 O94806 1/20 0.34
PRKCG P05129 1/20 0.34
PRKCB P05771 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
SCHEMBL10729252 0.98 ACE2 (0.50) ACE2ADH1BADH1CADH1AADH4
SCHEMBL15054217 0.96 ACE2 (0.52) ACE2ADH1BADH1CADH1AADH4
SCHEMBL28643649 0.91 ACE2 (0.52) ACE2ADH1BADH1CADH1AADH4
SCHEMBL13784898 0.91
SCHEMBL8080117 0.91
SCHEMBL277790 0.91
SCHEMBL1784986 0.89 LMNA (0.39) ACE2ADH1BADH1CADH1AADH4
SCHEMBL21869 0.89 ADH1B (0.54) ACE2ADH1BADH1CADH1AADH4
SCHEMBL1869609 0.89 ADH1B (0.54) ACE2ADH1BADH1CADH1AADH4
SCHEMBL18251822 0.89 ADH1B (0.54) ACE2ADH1BADH1CADH1AADH4

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
US-5104888-A Anticholesterol or antidiabetic agents SANKYO COMPANY, LIMITED (JP) 1992-04-14 US disclosed
EP-0207581-B1 THIAZOLIDINE DERIVATIVES, THEIR PREPARATION AND USE SANKYO COMPANY LIMITED (JP) 1990-09-12 EP disclosed
EP-0207581-A2 Thiazolidine derivatives, their preparation and use SANKYO COMPANY LIMITED (JP) 1987-01-07 EP disclosed