SCHEMBL10697469

SCHEMBL10697469

CC=CCCCCC=CC(O)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASAH2 Q9NR71 1/20 0.42
SPHK2 Q9NRA0 6/20 0.42
SPHK1 Q9NYA1 6/20 0.42
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
CETP P11597 5/20 0.42
MAPT P10636 5/20 0.42
THRB P10828 3/20 0.42
MAPK1 P28482 3/20 0.42
CYP2D6 P10635 3/20 0.42
LMNA P02545 3/20 0.42
ALDH1A1 P00352 3/20 0.42
TP53 P04637 3/20 0.42
GMNN O75496 2/20 0.42
GLA P06280 2/20 0.42
POLB P06746 2/20 0.42
CXCR5 P32302 2/20 0.42
CCR6 P51684 2/20 0.42
BLM P54132 2/20 0.42
UBE2N P61088 2/20 0.42

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
SCHEMBL10697463 1.00 ASAH2 (0.42) ASAH2SPHK2SPHK1MEN1KMT2A
SCHEMBL17350089 0.91 PPARG (0.34) ASAH2SPHK2SPHK1MEN1KMT2A
SCHEMBL17350090 0.91 PPARG (0.34) ASAH2SPHK2SPHK1MEN1KMT2A
Acetic Acid SCHEMBL10697760 0.91 ASAH2 (0.44) ASAH2SPHK2SPHK1MEN1KMT2A
Butyric Acid SCHEMBL10697467 0.85 ASAH2 (0.47) ASAH2KMT2AMAPTLMNAGMNN
SCHEMBL10699279 0.81 SPHK2 (0.62) ASAH2SPHK2SPHK1MEN1KMT2A
Hydrochloric Acid SCHEMBL11767811 0.81 SPHK2 (0.58) ASAH2SPHK2SPHK1MEN1KMT2A
SCHEMBL17703964 0.81 SPHK2 (0.62) ASAH2SPHK2SPHK1MEN1KMT2A
Hydrochloric Acid SCHEMBL11767806 0.81 SPHK2 (0.58) ASAH2SPHK2SPHK1MEN1KMT2A
SCHEMBL10699276 0.81 SPHK2 (0.62) ASAH2SPHK2SPHK1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0283946-A1 Novel intermediates useful in preparing vitamin E F. HOFFMANN-LA ROCHE AG (CH) 1988-09-28 EP disclosed