SCHEMBL6959879

SCHEMBL6959879

CCC(=O)N1C(=O)c2ccccc2OC12CCCCC2

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CES1 P23141 2/20 0.39
MAPT P10636 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
CNR2 P34972 3/20 0.36
TP53 P04637 1/20 0.36
OPRD1 P41143 2/20 0.35
KCNH2 Q12809 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
THRB P10828 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL8626816 1.00 ALDH1A1 (0.41) ALDH1A1KDM4EHTTSMN1; SMN2CES1
SCHEMBL8625977 0.99 KDM4E (0.40) ALDH1A1KDM4EHTTSMN1; SMN2CES1
SCHEMBL28129243 0.80 ALDH1A1 (0.39) ALDH1A1KDM4EHTTMAPTHRH3
SCHEMBL7504135 0.80 ALDH1A1 (0.39) ALDH1A1KDM4EHTTMAPTHRH3
SCHEMBL8624515 0.80 CES1 (0.43) ALDH1A1KDM4EHTTSMN1; SMN2CES1
SCHEMBL8624518 0.80 CES1 (0.43) ALDH1A1KDM4EHTTSMN1; SMN2CES1
SCHEMBL7783261 0.75 CES1 (0.40) ALDH1A1KDM4EHTTSMN1; SMN2CES1
SCHEMBL8623432 0.74 CES1 (0.39) ALDH1A1KDM4EHTTSMN1; SMN2CES1
SCHEMBL28465551 0.74 CNR2 (0.35) ALDH1A1KDM4EHTTMAPTHRH3
SCHEMBL8623299 0.73 CES1 (0.38) ALDH1A1KDM4EHTTSMN1; SMN2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6340751-B1 REACTION OF IMIDAZOLONE WITH AMIDE AND MAGNESIUM COMPOUND TAKASAGO INTERNATIONAL CORPORATION (JP) 2002-01-22 US claimed
CN-109939114-A Meropenem intermediate related compound and its application in anti-tumor drug 江苏汉阔生物有限公司 2019-06-28 CN disclosed
EP-0974582-B1 Process for the preparation of 4-substituted azetidinone derivatives TAKASAGO PERFUMERY CO LTD (JP) 2003-02-12 EP disclosed
US-6340751-B1 REACTION OF IMIDAZOLONE WITH AMIDE AND MAGNESIUM COMPOUND TAKASAGO INTERNATIONAL CORPORATION (JP) 2002-01-22 US disclosed
EP-0635488-B1 Novel process for preparing azetidinone compound and novel starting compound therefor TANABE SEIYAKU CO (JP) 2001-09-26 EP disclosed
EP-0974582-A1 Process for the preparation of 4-substituted azetidinone derivatives Takasago International Corporation (JP) 2000-01-26 EP disclosed
US-5792861-A Process for the production of 4-substituted azetidinone derivative TANABE SEIYAKU CO., LTD. (JP) 1998-08-11 US disclosed
US-5703234-A CHEMICAL INTERMEDIATE FOR 1-METHYLCARBAPENEM ANTIBIOTICS TANABE SEIYAKU CO., LTD. (JP) 1997-12-30 US disclosed
EP-0632037-B1 Process for the production of 4-substituted azetidinone derivatives TANABE SEIYAKU CO (JP) 1997-10-01 EP disclosed
US-5550229-A REACTING SPECIFIED ALKANAMIDE WITH SUBSTITUTED AZETIDINONE IN PRESENCE OF BASE TANABE SEIYAKU CO., LTD. (JP) 1996-08-27 US disclosed
EP-0635488-A2 Novel process for preparing azetidinone compound and novel starting compound therefor TANABE SEIYAKU CO., LTD. (JP) 1995-01-25 EP disclosed
EP-0632037-A1 Process for the production of 4-substituted azetidinone derivative TANABE SEIYAKU CO., LTD. (JP) 1995-01-04 EP disclosed