SCHEMBL11213670

SCHEMBL11213670

CCCCCS(=O)(=O)N1CCC=N1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.35
CA2 P00918 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
MMP8 P22894 2/20 0.31
MMP3 P08254 1/20 0.31
SMYD3 Q9H7B4 2/20 0.31
THRB P10828 2/20 0.30
FKBP1A P62942 1/20 0.30
HTR6 P50406 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
SCHEMBL6897802 0.73 FAAH (0.40) FAAHCA2ALDH1A1MAPTMMP8
SCHEMBL6904571 0.71 FAAH (0.35) FAAHCA2ALDH1A1MAPTSMN1; SMN2
SCHEMBL6901404 0.69 FAAH (0.36) FAAHCA2ALDH1A1MAPTMMP8
SCHEMBL10722736 0.69 FAAH (0.48) FAAHCA2ALDH1A1THRB
SCHEMBL7122564 0.69 FAAH (0.48) FAAHCA2ALDH1A1THRB
SCHEMBL10721831 0.69 FAAH (0.48) FAAHCA2ALDH1A1THRB
SCHEMBL6897175 0.68 FAAH (0.35) FAAHCA2ALDH1A1MAPTMMP8
SCHEMBL6901401 0.67 FAAH (0.41) FAAHCA2ALDH1A1MAPT
SCHEMBL6897804 0.67 FAAH (0.41) FAAHCA2ALDH1A1MAPTTHRB
SCHEMBL1069645 0.67 FAAH (0.41) FAAHCA2ALDH1A1MAPT

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-0048372-B1 PROCESS FOR PREPARING PYRAZOLE BAYER AG (DE) 1983-10-26 EP disclosed
EP-0048372-A2 Process for preparing pyrazole BAYER AG (DE) 1982-03-31 EP disclosed