SCHEMBL10790502

SCHEMBL10790502

C=CCOC(=O)NCC(=O)S[C@@H]1[C@@H](C(C)OC(=O)OCC=C)C(=O)N1C(C(=O)OCC=C)=P(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FAAH O00519 9/20 0.37
CASP1 P29466 5/20 0.34
MGLL Q99685 2/20 0.34
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.31

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
SCHEMBL10691169 1.00 FAAH (0.37) FAAHCASP1MGLLALDH1A1MAPT
SCHEMBL10788745 0.89 FAAH (0.34) FAAHCASP1MGLLALDH1A1MAPT
SCHEMBL10418969 0.88 CASP1 (0.38) FAAHCASP1MGLLALDH1A1MAPT
SCHEMBL10420401 0.88 CASP1 (0.37) FAAHCASP1MGLL
SCHEMBL10418784 0.87 CASP1 (0.37) FAAHCASP1MGLLMAPT
SCHEMBL10788741 0.87 FAAH (0.33) FAAHMGLL
SCHEMBL10418694 0.86 FAAH (0.42) FAAHCASP1MGLLMAPT
SCHEMBL10418684 0.86 FAAH (0.31) FAAH
SCHEMBL10419988 0.85 CASP1 (0.33) FAAHCASP1MGLLALDH1A1
SCHEMBL10420419 0.85 CASP1 (0.34) FAAHCASP1ALDH1A1MAPT

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-4656165-A Aminomethyl penem compounds CIBA-GEIGY CORPORATION (US) 1987-04-07 US disclosed