SCHEMBL11537334

SCHEMBL11537334

CCCCCC1(C)C(=O)N(CCO)C(=O)N1CCO

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.31
PTGS2 P35354 3/20 0.31
MGLL Q99685 2/20 0.31
FAAH O00519 1/20 0.31
GBA1 P04062 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C19 P33261 1/20 0.30
UNG P13051 2/20 0.30
KDM4E B2RXH2 1/20 0.30
PKM P14618 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
SCHEMBL11536097 0.98 PTGS1 (0.33) PTGS1PTGS2MGLLFAAHGBA1
SCHEMBL11535701 0.98 PTGS1 (0.33) PTGS1PTGS2MGLLFAAHGBA1
SCHEMBL11538979 0.82 PTGS1 (0.34) PTGS1PTGS2MGLLFAAHGBA1
SCHEMBL11541998 0.82 PTGS1 (0.34) PTGS1PTGS2MGLLFAAHGBA1
SCHEMBL13853151 0.80 TP53 (0.32)
SCHEMBL11765985 0.79 ALDH1A1 (0.32)
SCHEMBL11540976 0.79 PTGS1 (0.33) PTGS1PTGS2MGLLFAAHGBA1
SCHEMBL11534562 0.79 L3MBTL1 (0.31)
SCHEMBL11426999 0.77 PTGS1 (0.42) PTGS1PTGS2MGLLFAAHGBA1
SCHEMBL11790748 0.74

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
US-4150234-A WATER RESISTANT CIBA-GEIGY CORPORATION (US) 1979-04-17 US disclosed