SCHEMBL7655843

SCHEMBL7655843

CC(=O)Nc1cccc2c1C(=O)C(NC(C)=O)CS2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.43
NPSR1 Q6W5P4 2/20 0.43
LMNA P02545 2/20 0.43
HTT P42858 1/20 0.43
MAOA P21397 1/20 0.43
HPGD P15428 3/20 0.42
ALDH1A1 P00352 2/20 0.42
GAA P10253 1/20 0.42
HSD17B10 Q99714 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.40
MAPT P10636 2/20 0.40
CASP3 P42574 1/20 0.40
CCNE2 O96020 3/20 0.40
CCNE1 P24864 3/20 0.40
CDK2 P24941 3/20 0.40
AHR P35869 1/20 0.36
RAB9A P51151 2/20 0.36
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 1/20 0.36
MEN1 O00255 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
SCHEMBL7657484 0.83 KDM4E (0.41) KDM4ENPSR1LMNAHTTHPGD
SCHEMBL7660534 0.78 KDM4E (0.37) KDM4ENPSR1LMNAHTTMAOA
SCHEMBL7658175 0.77 KDM4E (0.39) KDM4ENPSR1LMNAHTTMAOA
SCHEMBL7658951 0.75 HDAC1 (0.35) KDM4ENPSR1LMNAHTTMAOA
SCHEMBL7653374 0.75 KDM4E (0.50) KDM4ELMNAMAOAHPGDALDH1A1
SCHEMBL7655192 0.73 CCNE2 (0.44) KDM4ENPSR1LMNAMAOAHPGD
SCHEMBL7662566 0.72 MAOA (0.47) KDM4EMAOAHPGDALDH1A1GAA
SCHEMBL26672573 0.70 KDM4E (0.35) KDM4ENPSR1LMNAHTTSMN1; SMN2
SCHEMBL7664370 0.69 LMNA (0.49) KDM4ENPSR1LMNAMAOAHPGD
SCHEMBL8853317 0.68 ALDH1A1 (0.44) KDM4EHTTHPGDALDH1A1GAA

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