SCHEMBL7657382

SCHEMBL7657382

Nc1cc(F)c(F)c2c1C(=O)C(NC(=O)C(F)(F)F)CC2

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 6/20 0.34
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 2/20 0.34
HTT P42858 2/20 0.33
NCOA1 Q15788 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
RAB9A P51151 1/20 0.32
SCN9A Q15858 3/20 0.32
HTR1A P08908 1/20 0.30
DRD2 P14416 1/20 0.30
KCNH2 Q12809 1/20 0.30

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
SCHEMBL26471261 0.88 LMNA (0.34) CRBNKDM4EALDH1A1HTTNCOA1
SCHEMBL7652983 0.88 LMNA (0.34) CRBNKDM4EALDH1A1HTTNCOA1
SCHEMBL30138591 0.85 LMNA (0.43) CRBNKDM4ELMNARAB9A
SCHEMBL24728401 0.85 LMNA (0.43) CRBNKDM4ELMNARAB9A
SCHEMBL7654782 0.79 KDM4E (0.34) CRBNKDM4EALDH1A1HTTNCOA1
SCHEMBL37106799 0.74 LMNA (0.42) CRBNKDM4ELMNARAB9A
SCHEMBL22200929 0.74 LMNA (0.42) CRBNKDM4ELMNARAB9A
SCHEMBL7165490 0.74 LMNA (0.42) CRBNKDM4ELMNARAB9A
SCHEMBL30841804 0.74 KDM4E (0.42) CRBNKDM4ELMNA
SCHEMBL6952434 0.73 HTT (0.39) CRBNKDM4EALDH1A1HTTNCOA1

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