SCHEMBL27917854

SCHEMBL27917854

Cc1ccc(CC(=N)CC(C)N2C=Cc3ccccc3C2)cc1

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 3/20 0.31
WDR77 Q9BQA1 3/20 0.31
FAAH O00519 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MGLL Q99685 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HDAC3 O15379 1/20 0.31
LMNA P02545 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B3 P37058 1/20 0.30
HCRTR2 O43614 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
SCHEMBL27917867 0.89 MEN1 (0.38) ALDH1A1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL27936354 0.88
SCHEMBL27936378 0.88 NAMPT (0.31)
SCHEMBL27917863 0.87 PRMT5 (0.36) PRMT5WDR77
SCHEMBL27917869 0.85 TMEM97 (0.42) KMT2AHSD17B3
SCHEMBL27917858 0.82 MEN1 (0.38) ALDH1A1MEN1KMT2ALMNA
SCHEMBL27936267 0.81 DRD2 (0.31)
SCHEMBL9809180 0.73 MEN1 (0.37) ALDH1A1MEN1KMT2AHDAC3HSD17B3
SCHEMBL27936399 0.71 MEN1 (0.33) MEN1KMT2AHDAC3
SCHEMBL27936286 0.71 MEN1 (0.33) MEN1KMT2AHDAC3

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
CN-103254172-A Cytoskeletal active rho kinase inhibitor compounds, composition and use INSPIRE PHARMACEUTICALS INC 2013-08-21 CN disclosed