SCHEMBL10933249

SCHEMBL10933249

CN(C)c1ccc(O)c(C#N)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
TSHR P16473 2/20 0.41
CYP19A1 P11511 1/20 0.40
MAPT P10636 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HSD17B10 Q99714 3/20 0.39
ALOX15 P16050 2/20 0.39
XDH P47989 1/20 0.38
GCGR P47871 1/20 0.38
IKBKB O14920 1/20 0.37
KDM4E B2RXH2 3/20 0.37
THRB P10828 2/20 0.37
HPGD P15428 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
APP P05067 2/20 0.36
TERT O14746 1/20 0.36
F11 P03951 1/20 0.36
RGS12 O14924 1/20 0.36
USP2 O75604 1/20 0.36

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
SCHEMBL6863864 0.79 MEN1 (0.39) ALDH1A1TSHRCYP19A1MAPTMEN1
SCHEMBL5017012 0.78 TSHR (0.45) ALDH1A1TSHRMAPTMEN1KMT2A
SCHEMBL3165753 0.76 TRPV4 (0.39) ALDH1A1TSHRMAPTMEN1KMT2A
SCHEMBL20732874 0.76 ALDH1A1 (0.39) ALDH1A1TSHRMAPTMEN1KMT2A
SCHEMBL29907686 0.76 TRPV4 (0.39) ALDH1A1TSHRMAPTMEN1KMT2A
SCHEMBL29330206 0.76 ALDH1A1 (0.41) ALDH1A1TSHRMAPTMEN1KMT2A
SCHEMBL13979471 0.76 ALDH1A1 (0.41) ALDH1A1TSHRMAPTMEN1KMT2A
SCHEMBL29330383 0.74 ALDH1A1 (0.37) ALDH1A1TSHRMAPTMEN1KMT2A
SCHEMBL4300398 0.73 TSHR (0.45) ALDH1A1TSHRMAPTMEN1KMT2A
SCHEMBL25540950 0.73 ALDH1A1 (0.59) ALDH1A1TSHRMAPTMEN1KMT2A

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-4517005-A Aminophenol urease inhibitors and urease inhibited urea based fertilizer compositions ALLIED CORPORATION (US) 1985-05-14 US disclosed