SCHEMBL19100359

SCHEMBL19100359

CCOC(=O)c1cccc2[nH]ncc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 3/20 0.58
ALDH1A1 P00352 3/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
KDM4E B2RXH2 3/20 0.54
TSHR P16473 1/20 0.53
CLEC4M Q9H2X3 1/20 0.47
CDC25B P30305 2/20 0.47
HSD17B10 Q99714 1/20 0.46
NPC1 O15118 2/20 0.46
GAA P10253 1/20 0.46
RAB9A P51151 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CYP1A2 P05177 1/20 0.45
ESR1 P03372 1/20 0.45
NUDT1 P36639 1/20 0.45
GABRP O00591 1/20 0.44
GABRD O14764 1/20 0.44
PDE5A O76074 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL543898 0.83 METTL3 (0.50) METTL3KDM4ETSHRNPC1RAB9A
SCHEMBL31719176 0.83 METTL3 (0.50) METTL3KDM4ETSHRNPC1RAB9A
Hydrochloric Acid SCHEMBL30715238 0.82 METTL3 (0.52) METTL3KDM4ETSHRNPC1RAB9A
SCHEMBL28267337 0.79 KDM4E (0.48) METTL3ALDH1A1KDM4EHSD17B10NPC1
SCHEMBL30591278 0.79 METTL3 (0.48) METTL3ESR1IDO1
SCHEMBL22886579 0.79 BRAF (0.52) METTL3ALDH1A1MEN1KMT2AKDM4E
SCHEMBL4155814 0.79 ALDH1A1 (0.50) METTL3ALDH1A1MEN1KMT2AKDM4E
SCHEMBL11577717 0.79 KMT2A (0.56) ALDH1A1MEN1KMT2AKDM4ETSHR
SCHEMBL7241231 0.79 DHFR (0.57) METTL3L3MBTL1ESR1IDO1
SCHEMBL2301267 0.79 ESR1 (0.50) METTL3ALDH1A1MEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020186220-A1 COMPOUNDS AS INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR IMMUNOPHAGE BIOMEDICAL CO., LTD. (CN) 2020-09-17 WO disclosed
CN-111132964-A Glucocorticoid receptor modulators 欧瑞克制药公司 2020-05-08 CN disclosed
EP-3400223-A1 MICROBIOCIDAL OXADIAZOLE DERIVATIVES Syngenta Participations AG (CH) 2018-11-14 EP disclosed
WO-2017118689-A1 MICROBIOCIDAL OXADIAZOLE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2017-07-13 WO disclosed