SCHEMBL13655513

SCHEMBL13655513

Bc1ccc(C2Oc3ccccc3NC3=C2C(=O)NC3)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
BRD4 O60885 2/20 0.37
CREBBP Q92793 2/20 0.37
PARP1 P09874 1/20 0.37
ABCC9 O60706 5/20 0.35
ABCC8 Q09428 5/20 0.35
KCNJ11 Q14654 5/20 0.35
KCNJ8 Q15842 5/20 0.35
LMNA P02545 3/20 0.33
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
PGR P06401 1/20 0.30

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
SCHEMBL13602802 0.90 KMT2A (0.59) MAPTKDM4EMEN1KMT2ACYP1A2
SCHEMBL13121245 0.88 CYP2C9 (0.62) MAPTKDM4EMEN1KMT2ACYP1A2
SCHEMBL13610022 0.71 MEN1 (0.46) MAPTKDM4EMEN1KMT2ACYP1A2
SCHEMBL31563597 0.69 LMNA (0.45) KDM4EBRD4CREBBPPARP1LMNA
SCHEMBL13610019 0.68 KDM4E (0.56) MAPTKDM4EMEN1KMT2ACYP1A2
SCHEMBL13610542 0.67 MEN1 (0.55) MAPTKDM4EMEN1KMT2ACYP1A2
SCHEMBL13602795 0.65 MEN1 (1.00) MAPTKDM4EMEN1KMT2ACYP1A2
SCHEMBL5670399 0.65 CA2 (0.62) KDM4EKMT2ABRD4CREBBPPARP1
SCHEMBL13602810 0.64 MEN1 (0.80) MAPTKDM4EMEN1KMT2ACYP1A2
SCHEMBL13602808 0.64 MEN1 (0.80) MAPTKDM4EMEN1KMT2ACYP1A2

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
EP-1346993-B1 LACTAM COMPOUNDS AND MEDICAL USE THEREOF AJINOMOTO KK (JP) 2009-10-21 EP disclosed