SCHEMBL7562147

SCHEMBL7562147

O=C(O)Oc1c(CN2C(=O)c3ccccc3C2=O)cccc1-c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 3/20 0.45
CD274 Q9NZQ7 3/20 0.45
KMT2A Q03164 2/20 0.45
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
CA12 O43570 1/20 0.44
CA9 Q16790 1/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 2/20 0.43
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
RECQL P46063 1/20 0.42
GRM5 P41594 1/20 0.41
CASP3 P42574 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40

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
SCHEMBL5697024 0.78 MAPT (0.54) PDCD1CD274KMT2AHDAC4HDAC1
SCHEMBL9754847 0.78 KMT2A (0.44) PDCD1CD274KMT2AHDAC1HDAC6
SCHEMBL5697864 0.77 GAA (0.47) KMT2ACA12CA9MEN1MAPT
SCHEMBL4659888 0.75 FOLH1 (0.61) PDCD1CD274KMT2A
SCHEMBL24253032 0.75 PDCD1 (0.65) PDCD1CD274KMT2AHDAC4HDAC1
SCHEMBL7987177 0.72 CASP3 (0.49) KMT2AHDAC1HDAC7CA12CA9
SCHEMBL24253049 0.71 MAPT (0.45) PDCD1CD274KMT2AHDAC4HDAC1
SCHEMBL1251436 0.71 KMT2A (0.56) KMT2AHDAC1HDAC7CA12CA9
SCHEMBL31751956 0.71 KMT2A (0.56) KMT2AHDAC1HDAC7CA12CA9
SCHEMBL18143536 0.69 HNF4A (0.58) KMT2AMEN1MAPTKDM4ERECQL

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
EP-1222163-A1 2'-SUBSTITUTED 1,1'-BIPHENYL-2-CARBONAMIDES, METHOD FOR THE PRODUCTION THEREOF, USE THEREOF AS A MEDICAMENT AND PHARMACEUTICAL PREPARATIONS CONTAINING SAID COMPOUNDS Aventis Pharma Deutschland GmbH (DE) 2002-07-17 EP disclosed
WO-2001025189-A1 2'-SUBSTITUTED 1,1'-BIPHENYL-2-CARBONAMIDES, METHOD FOR THE PRODUCTION THEREOF, USE THEREOF AS A MEDICAMENT AND PHARMACEUTICAL PREPARATIONS CONTAINING SAID COMPOUNDS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-04-12 WO disclosed