SCHEMBL14519086

SCHEMBL14519086

Cc1cccc2c1/C(=C/c1cn(C)c3ccccc13)C(=O)N2

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 5/20 0.70
MAP3K5 Q99683 1/20 0.70
KMT2A Q03164 6/20 0.65
MEN1 O00255 5/20 0.65
CRHBP P24387 1/20 0.65
CRHR2 Q13324 1/20 0.65
NTRK3 Q16288 3/20 0.64
NTRK2 Q16620 3/20 0.64
RET P07949 3/20 0.64
SYK P43405 2/20 0.64
MAPT P10636 2/20 0.64
KDR P35968 2/20 0.64
HDAC6 Q9UBN7 1/20 0.64
AURKA O14965 1/20 0.64
ROCK2 O75116 1/20 0.64
PRKD3 O94806 1/20 0.64
MAP4K4 O95819 1/20 0.64
CHEK2 O96017 1/20 0.64
INSR P06213 1/20 0.64
LCK P06239 1/20 0.64

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
SCHEMBL7130446 0.83 NTRK1 (0.63) NTRK1MAP3K5KMT2AMEN1CRHBP
SCHEMBL5469785 0.83 NTRK1 (1.00) NTRK1MAP3K5KMT2AMEN1CRHBP
SCHEMBL5469776 0.83 NTRK1 (1.00) NTRK1MAP3K5KMT2AMEN1CRHBP
SCHEMBL14448833 0.83 NTRK1 (1.00) NTRK1MAP3K5KMT2AMEN1CRHBP
SCHEMBL10095165 0.79 KMT2A (1.00) NTRK1MAP3K5KMT2AMEN1CRHBP
Gw441756X SCHEMBL5787769 0.78 KMT2A (1.00) NTRK1MAP3K5KMT2AMEN1CRHBP
Gw441756X SCHEMBL29794620 0.78 KMT2A (1.00) NTRK1MAP3K5KMT2AMEN1CRHBP
Gw441756X SCHEMBL16196749 0.78 KMT2A (1.00) NTRK1MAP3K5KMT2AMEN1CRHBP
Gw441756X SCHEMBL5787774 0.78 KMT2A (1.00) NTRK1MAP3K5KMT2AMEN1CRHBP
Gw441756X SCHEMBL29435064 0.78 KMT2A (1.00) NTRK1MAP3K5KMT2AMEN1CRHBP

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7202265-B2 Indolinone combinatorial libraries and related products and methods for the treatment of disease SUGEN, INC. (US) 2007-04-10 US disclosed
US-7202265-B2 Indolinone combinatorial libraries and related products and methods for the treatment of disease SUGEN, INC. (US) 2007-04-10 US disclosed