SCHEMBL7140878

SCHEMBL7140878

CCOc1ccc(C=C2C(=O)Nc3ccc(S(=O)(=O)NC)cc32)cc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.55
NTRK1 P04629 1/20 0.55
FCER2 P06734 1/20 0.55
NTRK3 Q16288 1/20 0.55
NTRK2 Q16620 1/20 0.55
SRC P12931 2/20 0.52
PSEN1 P49768 4/20 0.51
PSEN2 P49810 4/20 0.51
APH1B Q8WW43 4/20 0.51
NCSTN Q92542 4/20 0.51
APH1A Q96BI3 4/20 0.51
PSENEN Q9NZ42 4/20 0.51
CDK2 P24941 2/20 0.51
FLT3 P36888 1/20 0.51
LRRK2 Q5S007 1/20 0.50
KDR P35968 1/20 0.49
RET P07949 2/20 0.49

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
SCHEMBL7132943 0.92 PSEN1 (0.57) SYKNTRK1FCER2NTRK3NTRK2
SCHEMBL7132251 0.92 PSEN1 (0.54) SYKNTRK1FCER2NTRK3NTRK2
SCHEMBL5361448 0.88 SYK (0.65) SYKNTRK1FCER2NTRK3NTRK2
SCHEMBL7137979 0.88 PPARG (0.56) SYKNTRK1FCER2NTRK3NTRK2
SCHEMBL7137978 0.86 PSEN1 (0.62) SYKNTRK1FCER2NTRK3NTRK2
SCHEMBL7138289 0.86 SRC (0.58) SYKNTRK1FCER2NTRK3NTRK2
SCHEMBL7136635 0.85 NTRK1 (0.55) SYKNTRK1FCER2NTRK3NTRK2
SCHEMBL5362923 0.85 PSEN1 (0.54) SYKNTRK1FCER2NTRK3NTRK2
SCHEMBL5367155 0.85 NOX4 (0.52) SYKNTRK1FCER2NTRK3NTRK2
SCHEMBL7136883 0.84 SRC (0.58) SYKNTRK1FCER2NTRK3NTRK2

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-6506763-B2 Useful in prevention and treatment of protein kinase related disorders such as cancer SUGEN, INC. 2003-01-14 US disclosed