SCHEMBL29937801

SCHEMBL29937801

Cc1ccc(N(C(=O)Oc2ccccc2)C(=O)Oc2ccccc2)nc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
ATM Q13315 1/20 0.44
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
PTGES O14684 1/20 0.39
KMT2A Q03164 4/20 0.39
HSD17B10 Q99714 1/20 0.39
PKM P14618 1/20 0.39
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
HDAC9 Q9UKV0 1/20 0.38
USP2 O75604 1/20 0.38
MEN1 O00255 2/20 0.37
LIPE Q05469 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL2637165 0.77 RAB9A (0.44) TDP1ALDH1A1KDM4EKMT2AHSD17B10
SCHEMBL11670896 0.76 TDP1 (0.55) L3MBTL1TDP1ATMALDH1A1KDM4E
SCHEMBL2031522 0.75 SYK (0.38) L3MBTL1ALDH1A1KDM4EKMT2AHSD17B10
SCHEMBL10686148 0.73 RAB9A (0.44) TDP1ALDH1A1KDM4EKMT2AHSD17B10
SCHEMBL21241039 0.71 ALDH1A1 (0.41) L3MBTL1ATMALDH1A1KDM4EKMT2A
SCHEMBL9061345 0.70 TDP1 (0.47) L3MBTL1TDP1ATMALDH1A1KDM4E
SCHEMBL57851 0.70 TRPM8 (0.43) ALDH1A1KDM4EKMT2AHSD17B10MAPT
SCHEMBL5788823 0.70 RAB9A (0.58) L3MBTL1ALDH1A1KDM4EKMT2AHSD17B10
SCHEMBL14979242 0.70 CES2 (0.44) TDP1ALDH1A1KDM4EKMT2AHSD17B10
SCHEMBL11670902 0.69 ATM (0.50) L3MBTL1TDP1ATMALDH1A1PTGES

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
WO-2022220227-A1 TETRAHYDROPYRIDOPYRIMIDINE COMPOUND エーザイ・アール・アンド・ディー・マネジメント株式会社 2022-10-20 WO disclosed