SCHEMBL9501865

SCHEMBL9501865

CCCCCCCCCCCCCCCCCCS(=O)(=O)N(CC)CC

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.52
CA2 P00918 6/20 0.46
CNR2 P34972 1/20 0.46
TSHR P16473 1/20 0.40
THRB P10828 1/20 0.40
CES1 P23141 4/20 0.38
CES2 O00748 1/20 0.38

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
SCHEMBL10459109 1.00 FAAH (0.52) FAAHCA2CNR2TSHRTHRB
SCHEMBL28587125 0.97 FAAH (0.48) FAAHCA2CNR2CES1CES2
SCHEMBL14229678 0.91 CNR2 (0.49) FAAHCA2CNR2CES1CES2
SCHEMBL27373743 0.90 CNR2 (0.45) FAAHCA2CNR2TSHR
SCHEMBL14229169 0.89 CNR2 (0.46) FAAHCA2CNR2TSHRCES1
SCHEMBL6546381 0.87 FAAH (0.40) FAAHCA2CNR2CES1CES2
SCHEMBL14229131 0.86 FAAH (0.48) FAAHCA2CNR2CES1CES2
SCHEMBL9526928 0.86 CNR2 (0.51) FAAHCA2CNR2THRBCES1
SCHEMBL31722142 0.86 CNR2 (0.51) FAAHCA2CNR2THRBCES1
SCHEMBL7856362 0.86 CNR2 (0.51) FAAHCA2CNR2THRBCES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0398060-B1 Use of polyurethane mixtures as an adhesive binder for glueing blockpolymers of the SBS type. BAYER AG (DE) 1993-05-26 EP disclosed
US-5106446-A Containing an aromatic polycarbonate and(or) polycaprolactone BAYER AKTIENGESELLSCHAFT (DE) 1992-04-21 US disclosed
EP-0335183-A2 Polyurethane blends and their use as adhesives BAYER AG (DE) 1989-10-04 EP disclosed