SCHEMBL28964765

SCHEMBL28964765

COc1ccc(N(C)c2cc(=O)oc3ccccc23)cc1NC(=O)Cn1ccnc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.46
NPSR1 Q6W5P4 2/20 0.46
AHR P35869 1/20 0.46
MAPT P10636 3/20 0.46
CYP19A1 P11511 4/20 0.45
HSD17B10 Q99714 2/20 0.44
CYP17A1 P05093 1/20 0.43
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
RAB9A P51151 1/20 0.42
ALDH1A1 P00352 3/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
MAPK1 P28482 1/20 0.42
CYP2C19 P33261 1/20 0.42
LMNA P02545 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42

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
SCHEMBL28964758 0.86 MAPT (0.47) KDM4ENPSR1MAPTHSD17B10RAB9A
SCHEMBL28952139 0.84 MAPT (0.46) KDM4ENPSR1MAPTHSD17B10RAB9A
SCHEMBL28964725 0.84 ALDH1A1 (0.47) KDM4ENPSR1MAPTHSD17B10RAB9A
SCHEMBL28952149 0.83 MAPT (0.48) KDM4ENPSR1MAPTHSD17B10RAB9A
SCHEMBL20428309 0.83 ALDH1A1 (0.47) KDM4ENPSR1MAPTHSD17B10RAB9A
SCHEMBL28952542 0.82 ALDH1A1 (0.48) KDM4ENPSR1MAPTRAB9AALDH1A1
SCHEMBL20428330 0.82 ALDH1A1 (0.48) KDM4ENPSR1MAPTRAB9AALDH1A1
SCHEMBL28952234 0.82 ALDH1A1 (0.54) KDM4ENPSR1MAPTHSD17B10RAB9A
SCHEMBL28951962 0.82 MAPT (0.53) KDM4ENPSR1MAPTHSD17B10RAB9A
SCHEMBL28952266 0.82 ALDH1A1 (0.47) KDM4ENPSR1MAPTHSD17B10RAB9A

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
CN-115703755-B 2H-benzopyran-2-one derivatives and uses thereof 成都赜灵生物医药科技有限公司 2024-07-02 CN disclosed
CN-115703755-A 2H-benzopyran-2-one derivatives and uses thereof 成都赜灵生物医药科技有限公司 2023-02-17 CN disclosed