SCHEMBL28246995

SCHEMBL28246995

CCC(=O)Oc1ccc(-c2ccc(C(=O)N3CC[C@H](NC(=O)OC(C)(C)C)C3)cc2-c2ccc(C#N)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 20/20 0.57

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
SCHEMBL20512544 0.88 KDM1A (0.65) KDM1A
SCHEMBL20512861 0.88 KDM1A (0.74) KDM1A
SCHEMBL20512648 0.88 KDM1A (0.64) KDM1A
SCHEMBL28393640 0.87 KDM1A (0.63) KDM1A
SCHEMBL20512783 0.87 KDM1A (0.71) KDM1A
SCHEMBL28246994 0.87 KDM1A (0.63) KDM1A
SCHEMBL20512580 0.86 KDM1A (0.57) KDM1A
SCHEMBL20512468 0.86 KDM1A (0.69) KDM1A
SCHEMBL20512719 0.85 KDM1A (0.61) KDM1A
SCHEMBL20512530 0.85 KDM1A (0.78) KDM1A

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
CN-108602770-A Novel biphenol compound or its salt 大鹏药品工业株式会社 2018-09-28 CN disclosed