SCHEMBL10289971

SCHEMBL10289971

CNC(=O)c1cccc(C(C)=O)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.56
POLB P06746 1/20 0.48
P2RX7 Q99572 1/20 0.46
KDM4E B2RXH2 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
ACMSD Q8TDX5 1/20 0.45
GAA P10253 2/20 0.45
ALDH1A1 P00352 2/20 0.45
LMNA P02545 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
NPC1 O15118 1/20 0.45
MAPT P10636 1/20 0.45
MAPK1 P28482 1/20 0.45
RECQL P46063 1/20 0.45
RAB9A P51151 1/20 0.45
MCL1 Q07820 1/20 0.45
SMN1; SMN2 Q16637 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
SCHEMBL8403540 0.92 BRD4 (0.62) BRD4POLBP2RX7KDM4ETDP1
SCHEMBL455687 0.85 KDM4E (0.59) POLBP2RX7KDM4ETDP1ALOX15
SCHEMBL10289415 0.84 KDM4E (0.68) BRD4POLBKDM4ETDP1ALOX15
SCHEMBL30380244 0.84 KDM4E (0.68) BRD4POLBKDM4ETDP1ALOX15
Hydrochloric Acid SCHEMBL27613793 0.83 KDM4E (0.56) POLBP2RX7KDM4ETDP1ALOX15
SCHEMBL6641842 0.83 KDM4E (0.56) POLBP2RX7KDM4ETDP1ALOX15
SCHEMBL24638170 0.82 BRD4 (0.54) BRD4POLBP2RX7KDM4ETDP1
SCHEMBL30380080 0.82 BRD4 (0.54) BRD4POLBP2RX7KDM4ETDP1
SCHEMBL18246383 0.82 P2RX7 (0.68) BRD4POLBP2RX7KDM4ETDP1
SCHEMBL18519145 0.82 P2RX7 (0.68) POLBP2RX7KDM4ETDP1ALOX15

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-1953148-B1 HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2012-02-29 EP disclosed