SCHEMBL30719403

SCHEMBL30719403

CN1CCN(c2ncc[nH]c2=O)CC1=O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.44
PIM1 P11309 5/20 0.39
PIK3CA P42336 1/20 0.37
MTOR P42345 1/20 0.37
GRIA1 P42261 1/20 0.36
FGFR1 P11362 1/20 0.36
FGFR2 P21802 1/20 0.36
FGFR3 P22607 1/20 0.36
ACVR1 Q04771 1/20 0.36
LRRK2 Q5S007 6/20 0.34

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
SCHEMBL5237091 0.81 HRH4 (0.47)
SCHEMBL30719385 0.75 KDM4E (0.43) PIK3CAMTORGRIA1
SCHEMBL21552869 0.75 PDE10A (0.36) PDE10APIM1PIK3CAMTORGRIA1
SCHEMBL5233190 0.74 CYP3A4 (0.39) PDE10A
SCHEMBL30719404 0.74 JAK2 (0.53)
SCHEMBL30719381 0.73 LMNA (0.51)
SCHEMBL15135220 0.72 HTR2C (0.45)
SCHEMBL19035559 0.72 ALDH1A1 (0.50) PDE10APIM1FGFR1FGFR2FGFR3
SCHEMBL14858605 0.71 LMNA (0.47) PIK3CALRRK2
SCHEMBL23258716 0.68 PIK3CA (0.34) PDE10APIM1PIK3CAMTORGRIA1

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-112513020-B KDM1A inhibitors for the treatment of diseases 伊美格生物科学公司 2024-02-23 CN disclosed