SCHEMBL6665608

SCHEMBL6665608

COc1cc(C=Cc2cc(C(F)(F)F)nc(=O)[nH]2)cc(Cl)c1OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.55
ALDH1A1 P00352 4/20 0.55
MAPT P10636 4/20 0.55
LMNA P02545 3/20 0.55
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.40
HPGD P15428 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TUBB4A P04350 3/20 0.38
TUBB P07437 3/20 0.38
TUBA3C P0DPH7 3/20 0.38
TUBA1B P68363 3/20 0.38
TUBA4A P68366 3/20 0.38
TUBB4B P68371 3/20 0.38

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
SCHEMBL6665807 1.00 KDM4E (0.55) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL6589679 0.92 KDM4E (0.63) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL6589681 0.92 KDM4E (0.63) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL6664659 0.85 MEN1 (0.45) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL6597177 0.80 KDM4E (0.85) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL6597180 0.80 KDM4E (0.85) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL6664825 0.77 TNF (0.39) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL6661728 0.77 TNF (0.39) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL6597415 0.76 PDE3B (0.44) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL6597409 0.76 PDE3B (0.44) KDM4EALDH1A1MAPTLMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004016271-A1 PYRIMIDONES AS ANTIVIRAL AGENTS AXXIMA PHARMACEUTICALS AG (DE) 2004-02-26 WO claimed
WO-2004016271-A1 PYRIMIDONES AS ANTIVIRAL AGENTS AXXIMA PHARMACEUTICALS AG (DE) 2004-02-26 WO disclosed