SCHEMBL30719385

SCHEMBL30719385

O=C1CN(c2ncc[nH]c2=O)CCN1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.43
PRKCH P24723 1/20 0.40
PRKCE Q02156 1/20 0.40
GRIA1 P42261 8/20 0.38
PIK3CA P42336 1/20 0.37
MTOR P42345 1/20 0.37
OPRM1 P35372 2/20 0.36
OPRK1 P41145 2/20 0.36
OGFRL1 Q5TC84 2/20 0.36
OPRD1 P41143 1/20 0.36
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.35
PRKD1 Q15139 1/20 0.35
PRMT5 O14744 1/20 0.35
CACNG2 Q9Y698 1/20 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
SCHEMBL15135220 0.81 HTR2C (0.45) KDM4EALDH1A1
SCHEMBL30719404 0.76 JAK2 (0.53) KDM4EMAPTALDH1A1LMNAPOLB
SCHEMBL30719403 0.75 PDE10A (0.44) GRIA1PIK3CAMTOR
SCHEMBL5237091 0.73 HRH4 (0.47) POLB
SCHEMBL14858605 0.73 LMNA (0.47) KDM4EPIK3CAMAPTALDH1A1SMN1; SMN2
SCHEMBL10094631 0.72 HSD11B1 (0.46) KDM4EPRKCHPRKCEGRIA1PIK3CA
SCHEMBL14377416 0.72 GRIN2D (0.55) KDM4EPRKCHPRKCEGRIA1PIK3CA
SCHEMBL10512926 0.71 KDM4E (0.41) KDM4EPRKCHPRKCEGRIA1PIK3CA
SCHEMBL20953955 0.70 KDM4E (0.55) KDM4EPRKCHPRKCEPIK3CAOPRM1
SCHEMBL5233190 0.70 CYP3A4 (0.39) KDM4EMAPTALDH1A1

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