SCHEMBL2823274

SCHEMBL2823274

COC(=O)Oc1c(C)c(C(C)C)nc2cc(F)c(F)cc12

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
ATM Q13315 1/20 0.31
EGLN1 Q9GZT9 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
SCHEMBL2822997 0.83 L3MBTL1 (0.33) ALDH1A1
SCHEMBL2823122 0.81 ALDH1A1 (0.38) KDM4EALDH1A1HPGDATM
SCHEMBL2819564 0.75 PTGS2 (0.37) ALDH1A1HPGD
SCHEMBL2820524 0.74 GCGR (0.33)
SCHEMBL2819998 0.73 P2RX7 (0.32) ALDH1A1HPGD
SCHEMBL2820005 0.73 ALDH1A1 (0.34) KDM4EALDH1A1HPGD
SCHEMBL2823211 0.72 LMNA (0.38) KDM4EALDH1A1HPGD
SCHEMBL2819557 0.71 HTT (0.35) KDM4EALDH1A1HPGD
SCHEMBL2823560 0.70 KMT2A (0.35) KDM4EALDH1A1HPGD
SCHEMBL2850066 0.69 PLA2G2A (0.34) KDM4E

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
EP-1386914-B1 HALOGENATED QUINOLINE DERIVATIVES AND ECTOPARASITE CONTROLLERS MEIJI SEIKA KAISHA (JP) 2010-10-27 EP disclosed