SCHEMBL7658012

SCHEMBL7658012

COc1ccc(N)c2c1CC(NC(C)=O)CC2=O

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 5/20 0.54
MTNR1B P49286 5/20 0.54
ACHE P22303 1/20 0.40
LMNA P02545 2/20 0.40
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL8409849 0.76 MTNR1A (0.66) MTNR1AMTNR1B
SCHEMBL2060466 0.74 MTNR1A (0.53) MTNR1AMTNR1BACHELMNAKDM4E
SCHEMBL2060467 0.74 MTNR1A (0.53) MTNR1AMTNR1BACHELMNAKDM4E
SCHEMBL7655081 0.73 LMNA (0.62) MTNR1AMTNR1BLMNAMAPTKDM4E
SCHEMBL10277925 0.72 MTNR1A (0.56) MTNR1AMTNR1BACHELMNAMAPT
SCHEMBL11496541 0.72 MTNR1A (0.72) MTNR1AMTNR1BACHEMAPT
SCHEMBL2062138 0.72 MTNR1A (0.55) MTNR1AMTNR1BACHELMNAMAPT
SCHEMBL2062133 0.72 MTNR1A (0.55) MTNR1AMTNR1BACHELMNAMAPT
SCHEMBL10895786 0.70 ACHE (0.48) MTNR1AMTNR1BACHELMNAMAPT
SCHEMBL9404807 0.70 ALDH1A1 (0.73) ACHELMNAMAPTKDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6407115-B1 ANTICARCINOGENIC AND ANTITUMOR AGENTS; SIDE EFFECT REDUCTION, WATER SOLUBILITY DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2002-06-18 US disclosed
US-5834476-A DERIVATIVE OF CAMPTOTHECIN, ANTITUMOR AGENT, ANTICARCINOGENIC AGENT DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1998-11-10 US disclosed
US-5770605-A Method for treating leukemia with a hexa-cyclic compound DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1998-06-23 US disclosed
US-5658920-A ANTITUMOR AGENTS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1997-08-19 US disclosed
US-5637770-A Hexa-cyclic compound DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1997-06-10 US disclosed
EP-0495432-B1 Hexa-cyclic compound DAIICHI SEIYAKU CO (JP) 1996-05-29 EP disclosed
EP-0495432-A1 Hexa-cyclic compound DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1992-07-22 EP disclosed