SCHEMBL6892239

SCHEMBL6892239

CCc1nc(OC)c(N=C(NOC)N2CCN(c3cc(F)cc(F)c3)CC2)cc1C(=O)OC

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 6/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 3/20 0.34
NPY5R Q15761 2/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
ADAMTS5 Q9UNA0 2/20 0.32
HTT P42858 2/20 0.32
ADAMTS4 O75173 1/20 0.31
GAA P10253 2/20 0.31
LMNA P02545 2/20 0.31
THRB P10828 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
POLB P06746 1/20 0.31
PARP1 P09874 1/20 0.31

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
SCHEMBL6672628 0.93 KMT2A (0.37) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL6678774 0.83 TP53 (0.36) KMT2AMEN1MAPTKDM4EADAMTS5
SCHEMBL6679148 0.83 KMT2A (0.37) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL6678058 0.83 LMNA (0.34) KMT2AMEN1MAPTSMN1; SMN2HTT
SCHEMBL6672631 0.82 MAPT (0.38) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL6892244 0.81 MAPT (0.38) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL6673176 0.81 GAA (0.39) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL6674879 0.80 MAPT (0.39) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL6673164 0.80 PHGDH (0.31) MAPTKDM4EALDH1A1CYP2C19
SCHEMBL7044224 0.78 KMT2A (0.38) KMT2AMEN1MAPTKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6683184-B2 ANTITUMOR AGENTS SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2004-01-27 US disclosed