SCHEMBL7248239

SCHEMBL7248239

CCN1CCN(Cc2cc(-c3ccc4c(Nc5ccc(Oc6cccc(Cl)c6)cc5)c(C#N)cnc4c3)cs2)CC1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SRC P12931 14/20 0.57
FYN P06241 2/20 0.57
MAP2K1 Q02750 6/20 0.49
RAF1 P04049 5/20 0.49
MAPK3 P27361 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL3234414 0.92 SRC (0.57) SRCFYNMAP2K1RAF1MAPK3
SCHEMBL3233818 0.91 SRC (0.66) SRCFYNMAP2K1RAF1MAPK3
SCHEMBL3224239 0.87 SRC (0.62) SRCFYNMAP2K1RAF1
SCHEMBL3229392 0.85 MAP2K1 (0.69) SRCFYNMAP2K1RAF1MAPK3
SCHEMBL3223377 0.82 SRC (0.69) SRCFYNMAP2K1
SCHEMBL3231525 0.81 SRC (0.70) SRCFYNMAP2K1RAF1
SCHEMBL7673290 0.81 SRC (0.64) SRCFYNMAP2K1RAF1MAPK3
SCHEMBL3224684 0.81 SRC (0.57) SRCFYNMAP2K1
SCHEMBL3212451 0.80 SRC (0.64) SRCFYNMAP2K1
SCHEMBL3228485 0.80 SRC (0.60) SRCFYNMAP2K1RAF1

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-6521618-B2 Antineoplastic agents, agents for treatment of osteoporosis and polycystic kidney disease WYETH 2003-02-18 US disclosed