SCHEMBL30204409

SCHEMBL30204409

COC(=O)c1ccc2[nH]nc(C(F)(F)F)c2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
ALDH1A1 P00352 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
LMNA P02545 1/20 0.50
HTT P42858 1/20 0.50
MAP2K4 P45985 4/20 0.48
RAB9A P51151 2/20 0.48
NPC1 O15118 1/20 0.48
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47
NOTUM Q6P988 1/20 0.47
KIF11 P52732 2/20 0.46
STAT3 P40763 1/20 0.44
HIF1A Q16665 1/20 0.44
FLT3 P36888 1/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ATM Q13315 1/20 0.43
MAPK1 P28482 1/20 0.43
MAPKAPK3 Q16644 1/20 0.43

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
SCHEMBL17205475 1.00 KDM4E (0.50) KDM4EALDH1A1L3MBTL1LMNAHTT
SCHEMBL17447124 0.89 MAP2K4 (0.54) KDM4EALDH1A1L3MBTL1LMNAHTT
SCHEMBL13208508 0.87 KIF11 (0.53) KDM4EALDH1A1L3MBTL1LMNAHTT
SCHEMBL4404502 0.84 MAP2K4 (0.46) ALDH1A1MAP2K4KIF11MAPK1MAPKAPK3
SCHEMBL30205015 0.82 MAP2K4 (0.57) KDM4EALDH1A1MAP2K4HPGDKIF11
SCHEMBL2671448 0.82 MAP2K4 (0.57) KDM4EALDH1A1MAP2K4HPGDKIF11
SCHEMBL4400777 0.82 MAP2K4 (0.44) MAP2K4FLT3MAPK1MAPKAPK3MAPK6
SCHEMBL24422909 0.81 MAP2K4 (0.54) KDM4EALDH1A1L3MBTL1LMNAHTT
SCHEMBL16929779 0.80 JAK2 (0.58) KDM4EALDH1A1L3MBTL1MAP2K4RAB9A
SCHEMBL1501529 0.80 KDM4E (0.55) KDM4EALDH1A1L3MBTL1MAP2K4RAB9A

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-117858877-A C-linked inhibitors of ENL/AF9 YEATS 桥梁药品有限公司 2024-04-09 CN disclosed
EP-4337662-A1 C-LINKED INHIBITORS OF ENL/AF9 YEATS Bridge Medicines (US) 2024-03-20 EP disclosed
WO-2022240830-A1 C-LINKED INHIBITORS OF ENL/AF9 YEATS BRIDGE MEDICINES (US) 2022-11-17 WO disclosed