SCHEMBL7655081

SCHEMBL7655081

COc1ccc(N)c2c1CCC(NC(C)=O)C2=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.62
KDM4E B2RXH2 3/20 0.62
POLB P06746 1/20 0.62
MAPT P10636 1/20 0.62
MTNR1A P48039 2/20 0.48
MTNR1B P49286 2/20 0.48
TUBB1 Q9H4B7 5/20 0.47
CYP2C9 P11712 3/20 0.47
TUBB4A P04350 3/20 0.47
TUBB P07437 3/20 0.47
TUBA3C P0DPH7 3/20 0.47
TUBA1B P68363 3/20 0.47
TUBA4A P68366 3/20 0.47
TUBB4B P68371 3/20 0.47
TUBB3 Q13509 3/20 0.47
TUBB2A Q13885 3/20 0.47
TUBB8 Q3ZCM7 3/20 0.47
TUBA3E Q6PEY2 3/20 0.47
TUBA1A Q71U36 3/20 0.47
TUBA1C Q9BQE3 3/20 0.47

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
SCHEMBL7654640 0.87 LMNA (0.50) LMNAKDM4EPOLBMAPTMTNR1A
SCHEMBL7659820 0.83 LMNA (0.47) LMNAKDM4EPOLBMAPTMTNR1A
SCHEMBL30841469 0.83 LMNA (0.54) LMNAKDM4EPOLBMAPTMTNR1A
SCHEMBL7653009 0.82 LMNA (0.46) LMNAKDM4EPOLBMAPTTUBB1
SCHEMBL7661612 0.82 LMNA (0.46) LMNAKDM4EPOLBMAPTMTNR1A
SCHEMBL7655810 0.80 LMNA (0.44) LMNAKDM4EPOLBMAPTMTNR1A
SCHEMBL9093262 0.78 LMNA (0.62) LMNAKDM4EPOLBMAPTTUBB1
SCHEMBL30841546 0.77 LMNA (0.47) LMNAKDM4EPOLBMAPTTUBB1
SCHEMBL7657882 0.76 LMNA (0.51) LMNAKDM4EPOLBMAPTMTNR1A
SCHEMBL11720868 0.76 LMNA (0.71) LMNAKDM4EPOLBMAPTTUBB1

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 6 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-A1 Hexa-cyclic compound DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1992-07-22 EP disclosed