SCHEMBL29369136

SCHEMBL29369136

CNCc1ccccc1CN(CC(=O)Nc1ccc2c(c1)C[C@@]1(C2)C(=O)Nc2ncccc21)C(=O)C1(C)CCN(C(=O)C(C)C)CC1

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADM2 Q7Z4H4 20/20 0.71
CALCB P10092 19/20 0.71

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
SCHEMBL22014140 1.00 ADM2 (0.71) ADM2CALCB
SCHEMBL22014000 0.96 ADM2 (0.68) ADM2CALCB
SCHEMBL22014143 0.95 ADM2 (0.69) ADM2CALCB
SCHEMBL22013992 0.94 ADM2 (0.71) ADM2CALCB
SCHEMBL29368434 0.94 ADM2 (0.72) ADM2CALCB
SCHEMBL21963937 0.94 ADM2 (0.72) ADM2CALCB
SCHEMBL24962044 0.93 ADM2 (0.70) ADM2CALCB
SCHEMBL29369118 0.93 ADM2 (0.70) ADM2CALCB
SCHEMBL22014496 0.93 ADM2 (0.71) ADM2CALCB
SCHEMBL22014164 0.93 CALCB (0.75) ADM2CALCB

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-114007695-A As AM2Heterocyclic spiro-compounds as receptor inhibitors 谢菲尔德大学 2022-02-01 CN disclosed