SCHEMBL29518009

SCHEMBL29518009

CC(=O)Nc1ccc(C2=NC(=Cc3ccc(-n4cncn4)cc3)C(=O)O2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.47
CSNK2A2 P19784 3/20 0.46
CSNK2B P67870 3/20 0.46
CSNK2A1 P68400 3/20 0.46
MAPT P10636 3/20 0.43
ALDH1A1 P00352 3/20 0.43
F2 P00734 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ROCK1 Q13464 1/20 0.42
MAPK1 P28482 1/20 0.41
F10 P00742 1/20 0.41
PLG P00747 1/20 0.41
PLAU P00749 1/20 0.41
PLAT P00750 1/20 0.41
KLKB1 P03952 1/20 0.41

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
SCHEMBL22505139 1.00 KDM4E (0.47) KDM4ECSNK2A2CSNK2BCSNK2A1MAPT
SCHEMBL6796040 0.81 CSNK2A2 (0.60) KDM4ECSNK2A2CSNK2BCSNK2A1MAPT
SCHEMBL6796043 0.81 CSNK2A2 (0.60) KDM4ECSNK2A2CSNK2BCSNK2A1MAPT
SCHEMBL22501218 0.76 CSNK2A2 (0.53) CSNK2A2CSNK2BCSNK2A1MAPTALDH1A1
SCHEMBL22501219 0.76 CSNK2A2 (0.53) CSNK2A2CSNK2BCSNK2A1MAPTALDH1A1
SCHEMBL24534643 0.74 KDM4E (0.47) KDM4ECSNK2A2CSNK2BCSNK2A1MAPT
SCHEMBL29517991 0.74 KDM4E (0.47) KDM4ECSNK2A2CSNK2BCSNK2A1MAPT
SCHEMBL24241499 0.74 SMN1; SMN2 (0.49) KDM4ECSNK2A2CSNK2BCSNK2A1MAPT
SCHEMBL22505164 0.74 SMN1; SMN2 (0.49) KDM4ECSNK2A2CSNK2BCSNK2A1MAPT
SCHEMBL22500814 0.74 CSNK2A2 (0.47) KDM4ECSNK2A2CSNK2BCSNK2A1MAPT

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
WO-2022071777-A1 COMPOSITION AND METHOD FOR PREVENTION OR TREATMENT OF RESPIRATORY DISEASE 연세대학교 산학협력단 2022-04-07 WO claimed
WO-2022071777-A1 COMPOSITION AND METHOD FOR PREVENTION OR TREATMENT OF RESPIRATORY DISEASE 연세대학교 산학협력단 2022-04-07 WO disclosed