SCHEMBL4055271

SCHEMBL4055271

COc1ccc(-c2cc(=O)[nH]nc2C)cc1.COc1ccc(-c2cc(=O)[nH]nc2C)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.55
HTR3A P46098 3/20 0.55
KCNH2 Q12809 1/20 0.54
HRH3 Q9Y5N1 1/20 0.54
NOTUM Q6P988 1/20 0.46
MAPT P10636 3/20 0.46
KDM4E B2RXH2 3/20 0.46
THRB P10828 1/20 0.46
PKM P14618 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CCNE2 O96020 1/20 0.46
CDK4 P11802 1/20 0.46
CCND1 P24385 1/20 0.46
CCNE1 P24864 1/20 0.46
CDK2 P24941 1/20 0.46
NPC1 O15118 1/20 0.45
MAPK1 P28482 1/20 0.45
RAB9A P51151 1/20 0.45
MAP2K1 Q02750 1/20 0.45
KMT2A Q03164 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
SCHEMBL1372708 1.00 LMNA (0.55) LMNAHTR3AKCNH2HRH3NOTUM
SCHEMBL3946869 0.84 CDK4 (0.59) LMNANOTUMMAPTPKMCCNE2
SCHEMBL391623 0.81 CDK4 (0.57) LMNAKDM4ETDP1CCNE2CDK4
SCHEMBL15707624 0.81 DRD1 (0.56) LMNAHTR3AKDM4EDYRK1AHSD17B10
SCHEMBL8482163 0.81 JAK2 (0.53) HTR3AKCNH2HRH3MAPTKDM4E
SCHEMBL1375434 0.80 HTR3A (0.67) LMNAHTR3AKCNH2HRH3KMT2A
SCHEMBL3942034 0.78 CDK4 (0.53) LMNAMAPTKDM4ETDP1CCNE2
SCHEMBL3949166 0.78 CDK4 (0.53) LMNACCNE2CDK4CCND1CCNE1
SCHEMBL2847607 0.77 LMNA (0.55) LMNAHRH3NOTUMMAPTKDM4E
SCHEMBL3945127 0.77 PDE4A (0.61) LMNAMAPTKDM4ECCNE2CDK4

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-2069312-A2 PYRIDIZINONE DERIVATIVES Cephalon, Inc. (US) 2009-06-17 EP disclosed
WO-2008013838-A2 PYRIDIZINONE DERIVATIVES CEPHALON, INC. (US) 2008-01-31 WO disclosed