SCHEMBL30320602

SCHEMBL30320602

COc1cc(Cn2ccc(=O)[nH]c2=O)cc(OC)c1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DUT P33316 5/20 0.50
MTNR1A P48039 1/20 0.47
MTNR1B P49286 1/20 0.47
MAPT P10636 2/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
KMT2A Q03164 1/20 0.46
PKM P14618 1/20 0.44
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.41
ROCK2 O75116 1/20 0.41
LPO P22079 1/20 0.41
CRBN Q96SW2 1/20 0.41
BRD4 O60885 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL7759057 0.86 MAPT (0.57) DUTMAPTMEN1ALDH1A1KMT2A
SCHEMBL7255021 0.81 PKM (0.46) DUTMAPTALDH1A1PKMLMNA
SCHEMBL20334334 0.76 MAPT (0.58) DUTMAPTMEN1KMT2APKM
SCHEMBL20333609 0.76 PKM (0.51) DUTPKML3MBTL1CRBN
SCHEMBL2800300 0.75 DUT (0.59) DUTALDH1A1CRBN
SCHEMBL30072025 0.74 ROCK2 (0.46) MTNR1AMTNR1BTP53L3MBTL1ROCK2
SCHEMBL19370631 0.74 DAO (0.50) DUTMTNR1AMTNR1BMAPTMEN1
SCHEMBL29777943 0.73 L3MBTL1 (0.60) DUTMAPTALDH1A1KMT2APKM
SCHEMBL26043869 0.73 DUT (0.49) DUTPKML3MBTL1CRBN
SCHEMBL19370625 0.72 DUT (0.50) DUTALDH1A1PKMLMNAL3MBTL1

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-115785080-B Uracil parent nucleus compound and preparation method and application thereof 陕西盘龙药业集团股份有限公司 2024-10-11 CN disclosed
CN-115785080-A Uracil parent nucleus compound and preparation method and application thereof 陕西盘龙药业集团股份有限公司 2023-03-14 CN disclosed