SCHEMBL2299005

SCHEMBL2299005

CNC(=O)c1ccc2cccnc2c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.77
EGLN1 Q9GZT9 1/20 0.58
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
RIPK1 Q13546 1/20 0.55
CHRNA7 P36544 3/20 0.53
ALOX15 P16050 1/20 0.51
HTT P42858 1/20 0.51
MAPK14 Q16539 1/20 0.51
ALDH1A1 P00352 2/20 0.50
CASP1 P29466 1/20 0.50
CASP7 P55210 1/20 0.50
SLC40A1 Q9NP59 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
TRPM8 Q7Z2W7 2/20 0.49
GPR55 Q9Y2T6 1/20 0.48
TRPV1 Q8NER1 1/20 0.48
NPC1 O15118 1/20 0.48
POLB P06746 1/20 0.48
RAB9A P51151 1/20 0.48

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
SCHEMBL22260878 0.88 PLK1 (0.65) PLK1EGLN1MEN1KMT2ARIPK1
SCHEMBL11962154 0.87 PLK1 (1.00) PLK1MEN1KMT2ARIPK1ALOX15
SCHEMBL3362629 0.85 HDAC6 (0.65) PLK1EGLN1MEN1KMT2ACHRNA7
SCHEMBL13740774 0.83 RIPK1 (0.57) PLK1EGLN1MEN1KMT2ARIPK1
Hydrochloric Acid SCHEMBL13739996 0.82 RIPK1 (0.56) PLK1EGLN1MEN1KMT2ARIPK1
SCHEMBL9360254 0.81 MEN1 (0.55) PLK1EGLN1MEN1KMT2ACHRNA7
SCHEMBL29977567 0.81 MEN1 (0.55) PLK1EGLN1MEN1KMT2ACHRNA7
SCHEMBL17941874 0.81 EGLN1 (0.62) PLK1EGLN1MEN1KMT2ARIPK1
SCHEMBL29893321 0.81 ALOX15 (0.77) PLK1EGLN1MEN1KMT2ACHRNA7
SCHEMBL2671065 0.81 ALOX15 (0.77) PLK1EGLN1MEN1KMT2ACHRNA7

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115551864-A Substituted tricyclic amides, analogs thereof, and methods of using the same 爱彼特生物制药公司 2022-12-30 CN disclosed
EP-2519505-A1 NEW TERTIARY 8-HYDROXYQUINOLINE-7-CARBOXAMIDE DERIVATIVES AND USES THEREOF Polichem SA (LU) 2012-11-07 EP disclosed
WO-2011080264-A1 NEW TERTIARY 8-HYDROXYQUINOLINE-7-CARBOXAMIDE DERIVATIVES AND USES THEREOF POLICHEM S.A. (LU) 2011-07-07 WO disclosed