SCHEMBL4758346

SCHEMBL4758346

CCCCCCC(=O)C(C)C(C)C

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.59
MEN1 O00255 1/20 0.55
FAAH O00519 1/20 0.55
MAPK1 P28482 1/20 0.55
KMT2A Q03164 1/20 0.55
CES1 P23141 3/20 0.52
GPR84 Q9NQS5 2/20 0.50
PPARG P37231 2/20 0.50
PPARD Q03181 2/20 0.50
PPARA Q07869 2/20 0.50
ALDH1A1 P00352 1/20 0.50
TSHR P16473 1/20 0.50
SLC22A6 Q4U2R8 1/20 0.50
SLC22A8 Q8TCC7 1/20 0.50
TLR2 O60603 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
TDP1 Q9NUW8 1/20 0.50

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
SCHEMBL8090670 1.00 CES2 (0.59) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL24478517 1.00 CES2 (0.59) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL14654919 0.98 CES2 (0.56) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL2999572 0.91 CES2 (0.64) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL10686722 0.91 CES2 (0.48) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL2330133 0.82 CES2 (0.59) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL23950441 0.81 CES2 (0.64) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL2989445 0.81 CES2 (0.64) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL23950237 0.81 CES2 (0.64) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL21448801 0.81 CES2 (0.64) CES2MEN1FAAHMAPK1KMT2A

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
EP-1279686-B1 Polymers from triazine derivatives AMI AGROLINZ MELAMINE INT GMBH (AT) 2008-08-20 EP disclosed
EP-1279686-A2 Polymers from triazine derivatives Agrolinz Melamin GmbH (AT) 2003-01-29 EP disclosed