SCHEMBL6740746

SCHEMBL6740746

CCN1CCN(Cc2ccc(COc3ccc4c(Nc5cc(OC)c(Cl)cc5Cl)c(C#N)cnc4c3)cc2)CC1

nearest known ligand 0.81

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SRC P12931 20/20 0.81
FYN P06241 3/20 0.72
EGFR P00533 1/20 0.68
MAP2K1 Q02750 1/20 0.68

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
SCHEMBL3222282 0.90 SRC (1.00) SRCFYNEGFRMAP2K1
SCHEMBL3224206 0.85 SRC (1.00) SRCFYNEGFRMAP2K1
SCHEMBL3222680 0.83 SRC (1.00) SRCFYNEGFRMAP2K1
SCHEMBL3224481 0.83 SRC (1.00) SRCFYNEGFRMAP2K1
SCHEMBL7174603 0.82 SRC (0.85) SRCFYNEGFRMAP2K1
SCHEMBL3229384 0.82 SRC (0.89) SRCFYNEGFRMAP2K1
SCHEMBL3227471 0.81 SRC (1.00) SRCFYNEGFRMAP2K1
SCHEMBL3220031 0.81 SRC (0.87) SRCFYNEGFRMAP2K1
SCHEMBL3222269 0.81 SRC (1.00) SRCFYNEGFRMAP2K1
SCHEMBL3225828 0.81 SRC (0.89) SRCFYNEGFRMAP2K1

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-6689772-B1 ANTINEOPLASTIC AGENTS; OSTEOPOROSIS; POLYCYSTIC KIDNEY DISEASE; ANTIVIRAL AGENTS WYETH 2004-02-10 US disclosed