SCHEMBL8734175

SCHEMBL8734175

C=CCC1CCN(OC(=O)C=C)C1=O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.40
ELANE P08246 1/20 0.32
CTSG P08311 1/20 0.32
ALDH1A1 P00352 3/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
NOS1 P29475 1/20 0.30
NOS2 P35228 1/20 0.30
TP53 P04637 2/20 0.30
TSHR P16473 2/20 0.30
HIF1A Q16665 2/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL9115545 0.85 FAAH (0.31) FAAHALDH1A1TP53TSHRHIF1A
SCHEMBL169033 0.72 CYP3A4 (0.44) FAAHELANECTSGALDH1A1MEN1
SCHEMBL5597540 0.71 FAAH (0.51) FAAHELANECTSGALDH1A1MEN1
SCHEMBL360776 0.68 FAAH (0.40) FAAHALDH1A1MEN1KMT2ANOS1
SCHEMBL1645972 0.68 FAAH (0.40) FAAHELANECTSGALDH1A1MEN1
SCHEMBL26361631 0.67 FAAH (0.39) FAAHALDH1A1MEN1KMT2ANOS1
SCHEMBL626378 0.67 FAAH (0.43) FAAHELANECTSG
SCHEMBL7370726 0.66 MEN1 (0.33) FAAHELANECTSGALDH1A1MEN1
SCHEMBL2519451 0.64 LMNA (0.36) ALDH1A1MEN1KMT2ATP53TSHR
SCHEMBL28013983 0.64

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-0685535-B1 Radiation-curable compositions UCB SA (BE) 1998-01-07 EP claimed