SCHEMBL7299293

SCHEMBL7299293

Cn1cc(N)c(=O)c2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 4/20 0.50
IMPDH2 P12268 2/20 0.50
CCNE2 O96020 1/20 0.49
CDK4 P11802 1/20 0.49
CCND1 P24385 1/20 0.49
CCNE1 P24864 1/20 0.49
CDK2 P24941 1/20 0.49
POLB P06746 1/20 0.49
GPR84 Q9NQS5 1/20 0.48
CCNT1 O60563 1/20 0.47
CDK9 P50750 1/20 0.47
HTR2A P28223 1/20 0.47
LMNA P02545 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
NR4A2 P43354 1/20 0.45
IDO1 P14902 1/20 0.45

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
SCHEMBL31123023 0.84 GPR84 (0.55) KDM4EALDH1A1IMPDH2CCNE2CDK4
SCHEMBL13806393 0.84 GPR84 (0.55) KDM4EALDH1A1IMPDH2CCNE2CDK4
SCHEMBL436143 0.78 ALDH1A1 (0.52) KDM4EALDH1A1IMPDH2CCNE2CDK4
SCHEMBL1421538 0.77 ALDH1A1 (0.50) KDM4EALDH1A1IMPDH2CCNE2CDK4
SCHEMBL2747859 0.77 HTT (0.53) KDM4EALDH1A1IMPDH2CCNE2CDK4
SCHEMBL22734301 0.76 ALDH1A1 (0.49) KDM4EALDH1A1IMPDH2CCNE2CDK4
SCHEMBL15045828 0.76 GPR84 (0.61) KDM4EALDH1A1IMPDH2CCNE2CDK4
SCHEMBL10341064 0.75 KDM4E (0.71) KDM4EALDH1A1POLBLMNAL3MBTL1
SCHEMBL30542063 0.75 KDM4E (0.71) KDM4EALDH1A1POLBLMNAL3MBTL1
SCHEMBL10631604 0.75 CA2 (0.50) KDM4EALDH1A1IMPDH2CCNE2CDK4

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
WO-1991013061-A1 4(1H)QUINOLONE DERIVATIVES LABORATORIOS ALMIRALL, SA (ES) 1991-09-05 WO disclosed
EP-0445062-A1 4(1H)Quinolone derivatives LABORATORIOS ALMIRALL SA (ES) 1991-09-04 EP disclosed