SCHEMBL28664985

SCHEMBL28664985

Fc1ccc(-n2ccc3ccccc32)nc1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPT P10636 15/20 0.50
CDC7 O00311 2/20 0.50
CDK2 P24941 2/20 0.50
ROCK1 Q13464 2/20 0.50
BIRC5 O15392 1/20 0.41

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
SCHEMBL28687782 0.80 ROCK1 (0.50) MAPTCDC7CDK2ROCK1BIRC5
SCHEMBL28664976 0.80 CDC7 (0.50) MAPTCDC7CDK2ROCK1BIRC5
SCHEMBL28659589 0.80 BIRC5 (0.57) MAPTCDC7CDK2ROCK1BIRC5
SCHEMBL27929631 0.80 CDC7 (0.58) MAPTCDC7CDK2ROCK1BIRC5
SCHEMBL694441 0.78 MAPT (0.41) MAPTCDC7CDK2ROCK1
SCHEMBL28930283 0.76 CDC7 (0.53) MAPTCDC7CDK2ROCK1
SCHEMBL28929918 0.76 MAPT (0.51) MAPTCDC7CDK2ROCK1
SCHEMBL30324143 0.76 CDC7 (0.46) MAPTCDC7CDK2ROCK1
SCHEMBL27097236 0.76 MAPT (0.77) MAPTCDC7CDK2ROCK1
SCHEMBL31107087 0.75 CDC7 (0.60) MAPTCDC7CDK2ROCK1BIRC5

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
CN-110252351-B Application of copper catalyst in catalyzing reaction of 1-pyridyl indole compound and tert-butyl nitrite 苏州大学 2021-12-10 CN claimed
CN-110252351-B Application of copper catalyst in catalyzing reaction of 1-pyridyl indole compound and tert-butyl nitrite 苏州大学 2021-12-10 CN disclosed