SCHEMBL6202519

SCHEMBL6202519

[CH2]CC1CC2CCC1C2(C)C

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RET P07949 1/20 0.35
MAPK14 Q16539 1/20 0.35
CAMK1D Q8IU85 1/20 0.35
HDAC6 Q9UBN7 2/20 0.32

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
SCHEMBL8991557 0.83 RET (0.45) RETMAPK14CAMK1DHDAC6
SCHEMBL9793697 0.74 RET (0.36) RETMAPK14CAMK1DHDAC6
SCHEMBL11602001 0.74 RET (0.42) RETMAPK14CAMK1DHDAC6
SCHEMBL12873202 0.74 RET (0.31) RETMAPK14CAMK1D
SCHEMBL14769002 0.72 CYP2D6 (0.35) RETMAPK14CAMK1D
SCHEMBL11603418 0.72 RET (0.41) RETMAPK14CAMK1DHDAC6
SCHEMBL11604019 0.71 RET (0.40) RETMAPK14CAMK1DHDAC6
SCHEMBL11605095 0.70 RET (0.39) RETMAPK14CAMK1DHDAC6
SCHEMBL25442785 0.67
SCHEMBL4411047 0.67 RET (0.46) RETMAPK14CAMK1DHDAC6

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
EP-1539178-A2 PROTEASE INHIBITORS SmithKline Beecham Corporation (US) 2005-06-15 EP disclosed
WO-2004017911-A2 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-03-04 WO disclosed