SCHEMBL6958446

SCHEMBL6958446

CCC(=O)N1C(=O)COc2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.53
MEN1 O00255 3/20 0.53
POLB P06746 3/20 0.50
ALDH1A1 P00352 2/20 0.50
LMNA P02545 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
GAA P10253 1/20 0.49
CES1 P23141 1/20 0.49
HTT P42858 1/20 0.48
TSHR P16473 1/20 0.48
TP53 P04637 2/20 0.47
ALOX12 P18054 1/20 0.47
HSD17B3 P37058 1/20 0.47
CHRM1 P11229 1/20 0.46
CBX7 O95931 1/20 0.46
CDYL2 Q8N8U2 1/20 0.46
CDYL Q9Y232 1/20 0.46
CDY1; CDY1B Q9Y6F8 1/20 0.46

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
SCHEMBL5227565 0.82 KMT2A (0.50) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL28265104 0.81 MEN1 (0.52) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL474614 0.79 TSHR (0.60) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL28263925 0.77 TSHR (0.47) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL28265078 0.77 MEN1 (0.46) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL474484 0.76 CYP11B1 (0.51) KMT2AMEN1ALDH1A1CYP2C9CYP2C19
SCHEMBL17169390 0.76 NOTUM (0.70) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL5337208 0.75 BCHE (0.49) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL4432608 0.74 KMT2A (0.67) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL15762375 0.73 L3MBTL1 (0.47) KMT2AMEN1POLBALDH1A1LMNA

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 4 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
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-0974582-A1 Process for the preparation of 4-substituted azetidinone derivatives Takasago International Corporation (JP) 2000-01-26 EP disclosed