SCHEMBL16694902

SCHEMBL16694902

CN(C(=O)O)c1ccc(-c2c(N)nc(-n3nc(Cc4c(F)ccc(F)c4F)c4cc(Cl)ccc43)nc2N)cn1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GUCY1A1 Q02108 18/20 0.65
GUCY1B1 Q02153 18/20 0.65
KCNH2 Q12809 12/20 0.65
PDE5A O76074 1/20 0.49
CYP2C9 P11712 1/20 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
SCHEMBL2554909 0.90 GUCY1A1 (0.65) GUCY1A1GUCY1B1KCNH2PDE5ACYP2C9
SCHEMBL2520175 0.85 GUCY1A1 (0.82) GUCY1A1GUCY1B1KCNH2PDE5ACYP2C9
SCHEMBL2450715 0.85 GUCY1A1 (0.61) GUCY1A1GUCY1B1KCNH2PDE5ACYP2C9
SCHEMBL2447381 0.85 GUCY1A1 (0.60) GUCY1A1GUCY1B1KCNH2PDE5ACYP2C9
SCHEMBL14482391 0.85 GUCY1A1 (0.64) GUCY1A1GUCY1B1KCNH2PDE5ACYP2C9
SCHEMBL14481864 0.84 GUCY1A1 (0.65) GUCY1A1GUCY1B1KCNH2PDE5ACYP2C9
SCHEMBL14481707 0.83 GUCY1A1 (0.62) GUCY1A1GUCY1B1KCNH2PDE5ACYP2C9
SCHEMBL2449118 0.83 GUCY1A1 (0.62) GUCY1A1GUCY1B1KCNH2PDE5ACYP2C9
SCHEMBL2450595 0.80 GUCY1A1 (0.59) GUCY1A1GUCY1B1KCNH2PDE5A
SCHEMBL14482021 0.80 GUCY1A1 (0.70) GUCY1A1GUCY1B1KCNH2PDE5A

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-2549875-B1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS MERCK SHARP & DOHME (US) 2015-05-13 EP claimed