SCHEMBL6668773

SCHEMBL6668773

CN(C)CCc1cc2cc(CN3CCOCC3)cc3c(=O)c(C(=O)NCc4ccc(Cl)cc4)cn1c23

nearest known ligand 0.83

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 7/20 0.83
POLA1 P09884 2/20 0.83
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
F2 P00734 1/20 0.45
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.40
ENPP2 Q13822 1/20 0.40

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
SCHEMBL6708302 0.93 KCNH2 (0.81) KCNH2POLA1MEN1KMT2AF2
SCHEMBL6707899 0.92 KCNH2 (0.81) KCNH2POLA1MEN1KMT2AF2
SCHEMBL6706716 0.91 POLA1 (1.00) KCNH2POLA1MEN1KMT2AF2
SCHEMBL30419552 0.91 KCNH2 (1.00) KCNH2POLA1MEN1KMT2AF2
SCHEMBL6666985 0.91 KCNH2 (1.00) KCNH2POLA1MEN1KMT2AF2
SCHEMBL6669876 0.90 KCNH2 (0.89) KCNH2POLA1MEN1KMT2AF2
SCHEMBL6706361 0.89 POLA1 (0.94) KCNH2POLA1MEN1KMT2AF2
SCHEMBL6672185 0.89 KCNH2 (0.91) KCNH2POLA1MEN1KMT2AF2
SCHEMBL6706433 0.89 KCNH2 (0.87) KCNH2POLA1MEN1KMT2AF2
SCHEMBL6706701 0.89 POLA1 (0.93) KCNH2POLA1MEN1KMT2AF2

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
WO-2004019939-A1 METHOD OF PREVENTING OR TREATING ATHEROSCLEROSIS OR RESTENOSIS PHARMACIA & UPJOHN COMPANY (US) 2004-03-11 WO claimed