SCHEMBL19860040

SCHEMBL19860040

CNC(=O)c1cccc(CNCC(=O)Nc2ccc3cnccc3c2)c1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PRMT3 O60678 6/20 0.53
IMPDH2 P12268 5/20 0.51
NOTUM Q6P988 4/20 0.50
BMPR2 Q13873 1/20 0.45
ROCK2 O75116 3/20 0.44
ROCK1 Q13464 1/20 0.43

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
SCHEMBL19860064 0.87 PRMT3 (0.54) PRMT3IMPDH2NOTUMROCK2ROCK1
SCHEMBL20353460 0.86 IMPDH2 (0.71) PRMT3IMPDH2ROCK2
SCHEMBL3598327 0.85 PRMT3 (0.56) PRMT3IMPDH2NOTUMROCK2
SCHEMBL2162616 0.84 IMPDH2 (0.70) PRMT3IMPDH2NOTUMROCK2ROCK1
SCHEMBL2162395 0.84 ROCK2 (0.61) PRMT3IMPDH2NOTUMROCK2ROCK1
SCHEMBL14124375 0.83 ROCK1 (0.59) PRMT3IMPDH2NOTUMROCK2ROCK1
SCHEMBL2163047 0.83 NOTUM (0.65) PRMT3IMPDH2NOTUMROCK2ROCK1
SCHEMBL19860110 0.83 IMPDH2 (0.59) PRMT3IMPDH2NOTUMROCK2ROCK1
SCHEMBL14124373 0.82 NOTUM (0.55) PRMT3IMPDH2NOTUMROCK2
SCHEMBL19860124 0.81 IMPDH2 (0.59) PRMT3IMPDH2NOTUM

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-9890123-B2 6-aminoisoquinoline compounds AERIE PHARMACEUTICALS, INC. (US) 2018-02-13 US disclosed