SCHEMBL9206265

SCHEMBL9206265

CCCCCCC=CCCCCCCCCC(C)NCCC

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 1/20 0.47
ADH1C P00326 1/20 0.47
ADH1A P07327 1/20 0.47
ADH4 P08319 1/20 0.47
ADH7 P40394 1/20 0.47
PPARA Q07869 2/20 0.46
FAAH O00519 2/20 0.44
TRPV1 Q8NER1 1/20 0.44
CNR1 P21554 5/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL28275758 1.00 ADH1B (0.47) ADH1BADH1CADH1AADH4ADH7
SCHEMBL9204588 1.00 ADH1B (0.47) ADH1BADH1CADH1AADH4ADH7
SCHEMBL28277180 0.93 KDM4E (0.47) ADH1BADH1CADH1AADH4ADH7
SCHEMBL9204304 0.93 KDM4E (0.47) ADH1BADH1CADH1AADH4ADH7
SCHEMBL9206192 0.89 ADH1B (0.43) ADH1BADH1CADH1AADH4ADH7
SCHEMBL9211483 0.89 ADH1B (0.43) ADH1BADH1CADH1AADH4ADH7
SCHEMBL25072163 0.88 ADH1B (0.52) ADH1BADH1CADH1AADH4ADH7
SCHEMBL9214863 0.88 ADH1B (0.52) ADH1BADH1CADH1AADH4ADH7
SCHEMBL9205136 0.88 ADH1B (0.52) ADH1BADH1CADH1AADH4ADH7
SCHEMBL9289282 0.88 ADH1B (0.52) ADH1BADH1CADH1AADH4ADH7

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-0421441-B1 Pantothenic acid derivatives FUJIREBIO KK (JP) 1995-01-25 EP disclosed
US-5120738-A Cardiovascular disorders FUJIREBIO INC. (JP) 1992-06-09 US disclosed
EP-0421441-A2 Pantothenic acid derivatives FUJIREBIO INC. (JP) 1991-04-10 EP disclosed