SCHEMBL19980221

SCHEMBL19980221

NC(=O)c1cccc(COc2ccccc2)c1

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.72
PARP10 Q53GL7 3/20 0.69
MRGPRX4 Q96LA9 9/20 0.62
MAOB P27338 3/20 0.62
PARP15 Q460N3 1/20 0.62
PARP14 Q460N5 1/20 0.62
NR4A2 P43354 2/20 0.62
TP53 P04637 2/20 0.60
PKM P14618 2/20 0.60
NFKB1 P19838 2/20 0.60
NFKB2 Q00653 2/20 0.60
RELA Q04206 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
RAB9A P51151 1/20 0.60
RXFP1 Q9HBX9 1/20 0.60
F2 P00734 1/20 0.56
PTPRC P08575 1/20 0.56
PTPN1 P18031 1/20 0.56

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
SCHEMBL1387246 0.90 NR4A2 (0.77) F10PARP10MRGPRX4MAOBNR4A2
Hydrochloric Acid SCHEMBL27603151 0.89 NR4A2 (0.74) F10PARP10MAOBNR4A2F2
SCHEMBL4138759 0.87 NR4A2 (0.81) MRGPRX4NR4A2TP53PKMNFKB1
SCHEMBL15452708 0.86 PARP10 (0.74) PARP10MRGPRX4MAOBPARP15PARP14
SCHEMBL18297488 0.86 PARP10 (0.62) F10PARP10MRGPRX4MAOBPARP15
SCHEMBL17384527 0.86 PARP10 (0.68) F10PARP10MRGPRX4MAOBPARP15
SCHEMBL14169334 0.86 SMN1; SMN2 (0.76) PARP10MRGPRX4MAOBPARP15PARP14
SCHEMBL202497 0.84 F2 (0.61) PARP10MAOBPARP15PARP14NR4A2
SCHEMBL23189125 0.84 MAOB (0.82) F10MRGPRX4MAOBTP53PKM
SCHEMBL10814674 0.84 F10 (0.68) F10MRGPRX4MAOBNR4A2TP53

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-3342771-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GlaxoSmithKline Intellectual Property Development Ltd (GB) 2018-07-04 EP disclosed
EP-2956452-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2018-03-21 EP disclosed