SCHEMBL7801906

SCHEMBL7801906

CCCCCCCCCSCCCN1CCCCC1=O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.42
GAA P10253 1/20 0.40
KMT2A Q03164 3/20 0.39
ALOX5 P09917 2/20 0.39
MEN1 O00255 1/20 0.39
PIK3CD O00329 1/20 0.38
FAAH O00519 1/20 0.37
MGLL Q99685 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ADRA1B P35368 1/20 0.36

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
SCHEMBL7802935 0.95 GAA (0.42) RAB9AGAAKMT2AALOX5MEN1
SCHEMBL9653498 0.95 GAA (0.42) RAB9AGAAKMT2AALOX5MEN1
SCHEMBL9056157 0.95 RAB9A (0.43) RAB9AGAAKMT2AALOX5MEN1
SCHEMBL28520481 0.92 GAA (0.42) RAB9AGAAKMT2AALOX5MEN1
SCHEMBL7801728 0.92 ALOX5 (0.46) RAB9AGAAKMT2AALOX5PIK3CD
SCHEMBL9056711 0.92 ALOX5 (0.46) RAB9AGAAKMT2AALOX5PIK3CD
SCHEMBL10704838 0.91 RAB9A (0.41) RAB9AGAAKMT2AALOX5MEN1
SCHEMBL463370 0.89 ALOX5 (0.43) RAB9AGAAKMT2AALOX5MEN1
SCHEMBL9056134 0.89 ALOX5 (0.43) RAB9AGAAKMT2AALOX5MEN1
SCHEMBL24072918 0.89 ALOX5 (0.47) RAB9AGAAKMT2AALOX5PIK3CD

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-0555483-B1 PROCESS FOR PRODUCING AZACYCLOALKANE DERIVATIVE HISAMITSU PHARMACEUTICAL CO (JP) 2001-02-28 EP disclosed
US-5371238-A Reacting 1-/n-alkenyl/-azacycloalkan-2-one with alkyl mercaptan using free radical initiator, reducing, distilling to purify HISAMITSU PHARMACEUTICAL CO., INC. (JP) 1994-12-06 US disclosed
EP-0555483-A1 PROCESS FOR PRODUCING AZACYCLOALKANE DERIVATIVE Hisamitsu Pharmaceutical Co., Inc. (JP) 1993-08-18 EP disclosed